data_1yx6_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1yx6 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.276 0.56 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.428 ' CD2' HD22 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . 0.403 HG12 HG23 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.428 HD22 ' CD2' ' A' ' 95' ' ' TYR . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.41 HG22 HD11 ' B' ' 13' ' ' ILE . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.403 HG23 HG12 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.425 HD11 HG22 ' B' ' 23' ' ' ILE . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.449 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.424 HG13 HG21 ' B' ' 70' ' ' VAL . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.412 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.465 HG21 HD11 ' B' ' 61' ' ' ILE . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.402 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.424 HG21 HG13 ' B' ' 44' ' ' ILE . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.413 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.413 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.323 0.582 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.427 HD11 HG22 ' A' ' 93' ' ' ILE . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . 0.423 HG12 HG22 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.421 ' CE2' ' OE1' ' B' ' 2' ' ' GLN . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.408 HD12 HG23 ' B' ' 13' ' ' ILE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.423 HG22 HG12 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.428 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.403 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' B' ' 50' ' ' LEU . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.44 HG13 HG21 ' B' ' 70' ' ' VAL . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.456 ' CD2' ' CD2' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' CD2' ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.4 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.44 HG21 HG13 ' B' ' 44' ' ' ILE . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.455 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.416 HD12 HG22 ' A' ' 93' ' ' ILE . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' B' ' 8' ' ' LEU . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.444 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.444 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.499 HG12 ' HB2' ' A' ' 96' ' ' ALA . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.402 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.448 ' CD2' HD21 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.493 HG23 HD12 ' B' ' 61' ' ' ILE . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.412 HG12 ' N ' ' B' ' 71' ' ' LEU . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.412 ' N ' HG12 ' B' ' 70' ' ' VAL . 12.7 mt . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.282 0.563 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.435 ' CD2' HD22 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.517 ' HB3' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.473 ' CE1' ' CG2' ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.473 ' CG2' ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.477 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.42 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.42 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.413 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.416 ' HB3' ' CD1' ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.517 HG12 ' HB3' ' A' ' 96' ' ' ALA . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.458 HD23 ' CD2' ' B' ' 59' ' ' TYR . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.477 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.458 ' CD2' HD23 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.423 HG22 HD13 ' B' ' 61' ' ' ILE . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.473 ' CG2' ' HB1' ' A' ' 96' ' ' ALA . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.833 0.349 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.175 0.512 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.414 HD13 HG21 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.414 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.414 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.401 ' O ' HD12 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . 0.412 ' CG2' HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.446 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.446 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.411 HG23 HD12 ' B' ' 44' ' ' ILE . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.437 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.455 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.507 ' CD1' ' N ' ' B' ' 56' ' ' LEU . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.416 HG21 HD12 ' B' ' 61' ' ' ILE . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.812 0.339 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.222 0.534 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' B' ' 70' ' ' VAL . 58.0 mt-30 . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.401 HD12 HG22 ' A' ' 93' ' ' ILE . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB1' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.46 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' B' ' 14' ' ' THR . 0.2 OUTLIER -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.431 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.401 ' CG2' ' NE2' ' B' ' 2' ' ' GLN . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.461 HG23 HD12 ' B' ' 23' ' ' ILE . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.497 HG12 ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.435 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.427 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.443 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.0 t0 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.451 ' CD2' HD11 ' B' ' 8' ' ' LEU . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.451 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.446 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.417 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.428 HD23 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.446 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.431 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.431 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.44 HD11 HG23 ' B' ' 61' ' ' ILE . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.42 HG11 ' N ' ' B' ' 71' ' ' LEU . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.42 ' N ' HG11 ' B' ' 70' ' ' VAL . 20.4 mt . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.415 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.321 0.581 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.418 HD12 HG21 ' A' ' 93' ' ' ILE . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.421 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.421 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.425 HD13 HG22 ' B' ' 23' ' ' ILE . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.404 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.436 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.436 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 10.2 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' B' ' 59' ' ' TYR . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.461 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.409 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.431 HG12 ' N ' ' B' ' 71' ' ' LEU . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.431 ' N ' HG12 ' B' ' 70' ' ' VAL . 88.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.441 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.266 0.555 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.412 ' CG2' ' O ' ' A' ' 66' ' ' LEU . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.412 ' N ' ' CG2' ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.426 ' HA ' ' CE2' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.461 HD13 HG22 ' B' ' 13' ' ' ILE . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.409 HG13 ' HB3' ' B' ' 50' ' ' LEU . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.487 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.459 ' CD2' ' CG ' ' B' ' 59' ' ' TYR . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.459 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.42 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.287 0.565 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.421 HD13 HG23 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.443 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' B' ' 1' ' ' MET . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.475 HD13 HG23 ' B' ' 23' ' ' ILE . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.432 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.432 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.411 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.436 ' CD1' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.439 HD23 ' CD2' ' B' ' 59' ' ' TYR . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.439 ' CD2' HD23 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.478 HD13 HG21 ' B' ' 61' ' ' ILE . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.476 ' N ' ' CD2' ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . 0.443 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.43 ' CG2' ' HB1' ' A' ' 96' ' ' ALA . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.835 0.35 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.153 0.502 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.501 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . 0.416 ' CE1' HG22 ' B' ' 14' ' ' THR . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' THR . . . . . 0.416 HG22 ' CE1' ' B' ' 4' ' ' PHE . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.423 HD11 HG23 ' B' ' 23' ' ' ILE . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.408 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.486 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.486 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.501 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.459 HD21 ' CD2' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.435 HG21 HD13 ' B' ' 61' ' ' ILE . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.411 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.451 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.365 0.602 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.482 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.425 HD12 HG23 ' A' ' 93' ' ' ILE . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.445 ' CD2' ' CD1' ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.508 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.445 ' CD1' ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.508 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.439 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.416 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.421 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' B' ' 43' ' ' LEU . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . 0.414 ' CD1' HD12 ' B' ' 67' ' ' LEU . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.459 HG22 HD11 ' B' ' 61' ' ' ILE . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.414 HD12 ' CD1' ' B' ' 45' ' ' PHE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.407 HG11 ' N ' ' B' ' 71' ' ' LEU . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.407 ' N ' HG11 ' B' ' 70' ' ' VAL . 7.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.726 0.298 . . . . 0.0 110.592 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.424 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.276 0.56 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CD2' HD11 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.421 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.414 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.42 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.421 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.443 HD21 ' CD2' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.443 ' CD2' HD21 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.411 HG22 HD12 ' B' ' 61' ' ' ILE . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.414 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.41 HG13 ' N ' ' B' ' 71' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.41 ' N ' HG13 ' B' ' 70' ' ' VAL . 9.4 mt . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.28 0.562 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.498 ' CD1' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.498 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.492 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.477 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.419 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.456 HG13 ' HB3' ' B' ' 50' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.451 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.451 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.492 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' B' ' 23' ' ' ILE . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.441 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.403 ' N ' HG12 ' B' ' 70' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.419 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.195 0.521 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.419 HG22 HD11 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.428 ' CD2' HD11 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.423 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.451 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' B' ' 50' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 30' ' ' ILE . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.492 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.423 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.458 ' HB3' HG13 ' B' ' 23' ' ' ILE . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.445 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.429 ' CE2' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.434 HD12 HG23 ' B' ' 61' ' ' ILE . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.414 HG11 ' N ' ' B' ' 71' ' ' LEU . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . 0.414 ' N ' HG11 ' B' ' 70' ' ' VAL . 4.7 mt . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.451 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.204 0.526 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.401 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.423 HD11 HG23 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.447 ' CD2' ' CD1' ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.492 ' HB1' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.447 ' CD1' ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.456 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.418 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.492 HG12 ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.437 HD23 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CG ' HD23 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 96' ' ' ALA . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 N--CA 1.493 1.725 0 CA-C-O 121.216 0.531 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.417 HG22 HD13 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.416 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.419 HD11 HG21 ' B' ' 23' ' ' ILE . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . 0.407 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.411 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.462 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.462 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . 0.469 HD12 HG22 ' B' ' 61' ' ' ILE . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.416 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.413 HG22 HG13 ' B' ' 44' ' ' ILE . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.412 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.441 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.441 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.219 0.533 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.415 HD12 HG21 ' A' ' 93' ' ' ILE . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.447 ' CD2' HD12 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.485 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.478 HD13 HG22 ' B' ' 13' ' ' ILE . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' B' ' 50' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.528 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' GLN . . . . . 0.528 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ILE . . . . . 0.485 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' B' ' 23' ' ' ILE . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.447 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' TYR . . . . . 0.46 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' VAL . . . . . 0.42 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.156 0.503 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -148.19 -168.31 3.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.452 -0.78 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.3 mt -112.46 27.53 9.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.412 -0.805 . . . . 0.0 109.423 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.38 -39.28 5.1 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -148.87 33.81 0.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -1.089 . . . . 0.0 110.23 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -114.94 -80.25 0.89 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.23 25.08 11.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.341 -1.094 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 p -119.88 28.74 7.93 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.84 . . . . 0.0 110.16 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.4 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 6.4 p-10 -124.2 26.99 7.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.312 -0.868 . . . . 0.0 110.156 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.4 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 95.9 m-85 -123.71 0.3 8.68 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.367 -0.833 . . . . 0.0 110.563 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -59.91 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.183 -0.948 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 52.26 27.32 4.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.314 -0.866 . . . . 0.0 110.462 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.18 28.56 4.8 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.03 -51.98 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -1.079 . . . . 0.0 109.98 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -162.72 154.29 15.21 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.378 -0.826 . . . . 0.0 110.124 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.09 -30.89 12.91 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 O-C-N 123.775 1.408 . . . . 0.0 110.605 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 m -72.33 -6.88 46.35 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.265 -0.897 . . . . 0.0 110.8 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -84.29 3.28 36.27 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.148 -0.97 . . . . 0.0 110.643 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.6 120.14 0.59 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.108 -0.995 . . . . 0.0 109.937 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.45 -20.31 61.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.19 19.11 8.42 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.234 -0.916 . . . . 0.0 110.395 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.3 -43.24 1.63 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.986 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.93 -43.18 5.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 110.088 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -113.55 71.25 0.23 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.5 tt -61.14 -18.31 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.332 -1.099 . . . . 0.0 110.459 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.73 -173.16 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.316 -0.865 . . . . 0.0 110.394 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -58.12 162.49 3.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.272 -0.892 . . . . 0.0 110.374 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.5 m -152.71 -58.24 0.14 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.443 -0.786 . . . . 0.0 110.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.62 -56.54 0.02 OUTLIER Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.9 p -136.11 90.12 2.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -1.069 . . . . 0.0 110.105 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.6 52.73 1.94 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.326 -0.859 . . . . 0.0 110.217 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -53.66 4.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.353 -0.842 . . . . 0.0 110.231 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.84 73.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.378 -0.827 . . . . 0.0 110.284 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -74.53 -62.71 1.43 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -85.14 -51.17 6.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.27 -27.79 69.58 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.382 -0.824 . . . . 0.0 110.12 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 53.5 t80 -95.62 36.57 1.26 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.354 -0.841 . . . . 0.0 110.271 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -123.27 89.93 0.42 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 52.66 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.408 -1.054 . . . . 0.0 110.436 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.99 29.02 5.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.477 -0.764 . . . . 0.0 110.19 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.91 25.52 27.15 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' A' ' 83' ' ' ASP . 0.4 OUTLIER -161.5 150.13 12.94 Favored Pre-proline 0 N--CA 1.485 1.323 0 O-C-N 121.477 -1.014 . . . . 0.0 108.525 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 53.6 Cg_endo -77.78 31.45 0.43 Allowed 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 123.473 1.249 . . . . 0.0 110.832 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 39.7 m-20 60.14 149.29 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.83 . . . . 0.0 110.208 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.7 mt -135.66 -72.63 0.46 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.266 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -73.15 -7.01 49.52 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.412 -0.805 . . . . 0.0 110.667 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.7 m -79.63 -20.32 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.91 . . . . 0.0 110.17 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.434 ' HB2' ' HB3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -108.43 -142.5 0.38 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.268 -0.895 . . . . 0.0 110.122 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.2 p -135.1 179.73 6.14 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.886 -1.134 . . . . 0.0 110.76 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.9 pt-20 -66.05 -29.38 69.72 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.575 -0.703 . . . . 0.0 109.361 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.483 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.8 mp0 -78.44 -40.97 34.16 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 87' ' ' MET . 0.2 OUTLIER -64.3 -42.13 96.52 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.15 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -69.17 -33.92 74.14 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.576 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.428 ' CD2' HD22 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.87 -35.97 77.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.5 -32.68 62.59 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.15 -28.63 67.47 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.016 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 8.1 mtt -93.45 -30.28 15.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 110.153 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.409 ' HA ' ' CE1' ' B' ' 68' ' ' HIS . 63.3 m -60.87 -56.7 18.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.149 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.88 -12.03 61.31 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.404 -0.81 . . . . 0.0 110.496 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -101.07 34.12 2.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.247 -0.908 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.82 -80.35 1.06 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -101.64 89.1 3.59 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.364 -1.08 . . . . 0.0 110.192 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.89 78.14 1.58 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.345 -0.847 . . . . 0.0 110.18 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -112.88 64.27 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.335 -0.853 . . . . 0.0 110.078 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 134.91 -30.25 2.86 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 89.49 3.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.393 -1.063 . . . . 0.0 110.057 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.15 -139.95 0.38 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.951 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -111.7 59.66 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.166 -0.959 . . . . 0.0 110.27 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.1 m -84.96 158.15 20.61 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.187 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . 0.403 HG12 HG23 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.405 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.428 HD22 ' CD2' ' A' ' 95' ' ' TYR . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' THR . . . . . 0.405 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.41 HG22 HD11 ' B' ' 13' ' ' ILE . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.403 HG23 HG12 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.425 HD11 HG22 ' B' ' 23' ' ' ILE . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.449 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.449 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.424 HG13 HG21 ' B' ' 70' ' ' VAL . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.441 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.412 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.554 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.441 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.465 HD11 HG21 ' B' ' 61' ' ' ILE . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' A' ' 100' ' ' SER . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.424 HG21 HG13 ' B' ' 44' ' ' ILE . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt -94.07 129.51 40.58 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -103.06 124.87 49.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.319 -0.863 . . . . 0.0 110.167 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.02 86.81 2.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.82 32.77 0.4 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.289 -0.882 . . . . 0.0 110.067 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.4 114.75 1.34 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.603 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.193 0.52 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.34 -175.52 5.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -109.82 15.26 22.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.444 -0.785 . . . . 0.0 109.913 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.19 -44.68 6.92 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.1 mt -109.03 -23.13 11.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -1.086 . . . . 0.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -70.32 -63.59 3.2 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.41 36.57 20.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.29 -1.123 . . . . 0.0 110.305 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.5 p -166.13 -37.32 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.465 -0.772 . . . . 0.0 110.392 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -49.86 -28.5 6.58 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.274 -0.891 . . . . 0.0 110.516 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -102.25 89.92 3.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.395 -0.816 . . . . 0.0 109.974 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.76 72.06 1.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.341 -0.849 . . . . 0.0 110.454 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 51.32 25.63 2.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.366 -0.833 . . . . 0.0 110.551 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -121.97 47.8 1.0 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.4 t -135.48 -66.73 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -1.089 . . . . 0.0 110.08 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -155.54 155.75 30.05 Favored Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.355 -0.841 . . . . 0.0 110.109 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.05 -15.56 29.08 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 O-C-N 123.841 1.443 . . . . 0.0 110.666 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -6.65 49.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.234 -0.916 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.68 1.91 53.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.124 -0.985 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.22 113.71 1.42 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.0 109.995 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.413 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.413 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.52 -23.94 64.96 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -107.89 -10.63 15.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.344 -0.848 . . . . 0.0 110.514 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.35 -46.19 80.07 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.221 -0.924 . . . . 0.0 110.117 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -107.08 21.53 17.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.467 -0.77 . . . . 0.0 110.244 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.56 -43.65 0.49 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.2 pt -139.77 76.91 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -1.1 . . . . 0.0 110.351 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.75 101.12 3.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.091 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.0 t -159.01 148.1 18.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.38 -0.825 . . . . 0.0 110.329 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 20.9 p -127.63 77.88 1.78 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.81 94.63 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.7 t -73.2 67.13 0.92 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.386 -1.067 . . . . 0.0 110.335 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 76.16 0.97 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.342 -0.849 . . . . 0.0 110.144 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -166.62 -41.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.406 -0.809 . . . . 0.0 110.022 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.8 p -110.9 67.68 0.65 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.384 -0.822 . . . . 0.0 110.097 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -76.67 -53.53 7.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.285 -0.884 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -83.69 -46.33 12.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.0 -42.67 99.4 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.285 -0.884 . . . . 0.0 110.197 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -111.58 47.3 1.04 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.402 -0.811 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.15 -46.92 0.68 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -87.12 125.4 34.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.268 -1.136 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.9 m -154.12 45.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.845 . . . . 0.0 110.107 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.05 56.39 0.94 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.66 147.71 1.69 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.3 -1.118 . . . . 0.0 108.903 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.35 62.7 2.76 Favored 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 123.584 1.307 . . . . 0.0 110.392 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -59.48 99.58 0.06 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.387 -0.821 . . . . 0.0 110.178 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 mp -60.81 -41.04 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.39 -0.819 . . . . 0.0 110.315 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.6 m -59.89 -32.58 70.86 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.372 -0.83 . . . . 0.0 110.379 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 t -82.5 -30.27 29.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 110.042 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 16.0 mtp -76.45 117.67 18.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.455 -0.778 . . . . 0.0 110.083 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.429 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 66.9 p -80.16 -162.27 0.43 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.799 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -68.69 -31.98 71.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.488 -0.758 . . . . 0.0 109.53 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.508 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.6 pt-20 -85.55 -36.87 20.18 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.26 -48.03 71.8 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 60.4 mt-30 -63.27 -33.73 76.13 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.508 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.79 -25.5 32.69 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.4 ttm -84.11 -30.95 25.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.111 -0.993 . . . . 0.0 110.017 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -82.91 -27.01 30.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.449 -0.782 . . . . 0.0 110.515 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 21.9 ttp -91.69 -17.17 25.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.9 . . . . 0.0 110.579 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.421 ' OG ' ' ND1' ' B' ' 68' ' ' HIS . 72.4 m -93.14 -27.55 16.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.269 -0.894 . . . . 0.0 110.458 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.28 -27.25 65.66 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.41 -0.806 . . . . 0.0 109.754 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.36 -70.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.9 63.61 1.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -109.14 73.93 0.88 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.363 -1.081 . . . . 0.0 110.245 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -89.31 -62.41 1.49 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.239 -0.913 . . . . 0.0 110.164 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -133.62 -76.13 0.48 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.367 -0.833 . . . . 0.0 110.242 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.26 27.79 63.43 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -133.1 96.13 3.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -1.133 . . . . 0.0 110.235 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -169.19 52.85 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.371 -0.83 . . . . 0.0 109.991 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -151.53 29.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.368 -0.833 . . . . 0.0 110.258 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -165.0 171.11 14.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.383 -0.823 . . . . 0.0 110.124 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.255 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . 0.423 HG12 HG22 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.421 ' CE2' ' OE1' ' B' ' 2' ' ' GLN . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.408 HD12 HG23 ' B' ' 13' ' ' ILE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.423 HG22 HG12 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.428 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.428 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.403 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.4 ' HB3' HD12 ' B' ' 50' ' ' LEU . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.44 HG13 HG21 ' B' ' 70' ' ' VAL . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.456 ' CD2' ' CD2' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.476 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' CD2' ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.421 ' ND1' ' OG ' ' A' ' 100' ' ' SER . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.44 HG21 HG13 ' B' ' 44' ' ' ILE . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -93.99 125.37 38.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.0 176.8 5.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 40.3 mt -125.28 151.16 46.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.366 -0.834 . . . . 0.0 110.189 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -150.46 73.55 1.14 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.893 . . . . 0.0 110.182 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.05 33.79 86.45 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.55 -179.964 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.169 0.509 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 9.3 mtp -129.62 173.58 10.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.871 . . . . 0.0 110.347 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.47 23.29 14.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.814 . . . . 0.0 109.568 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.34 74.67 2.49 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.04 80.95 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.403 -1.057 . . . . 0.0 110.045 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.0 -122.5 0.77 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.82 92.04 1.52 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.318 -1.107 . . . . 0.0 110.255 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.89 -43.96 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.401 -0.812 . . . . 0.0 110.184 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -80.24 -27.19 38.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.41 -0.806 . . . . 0.0 110.193 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.441 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 28.8 p90 -169.42 125.4 0.87 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.347 -0.846 . . . . 0.0 110.112 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.65 43.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 110.308 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -124.63 61.87 1.14 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.999 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 124.27 -28.66 5.27 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.8 p -69.93 -27.02 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -1.088 . . . . 0.0 110.27 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -134.69 139.77 33.41 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.22 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.66 -12.04 28.61 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.591 1.311 . . . . 0.0 110.804 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -7.82 52.79 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.16 -0.962 . . . . 0.0 110.517 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -113.64 12.15 18.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.157 -0.964 . . . . 0.0 110.54 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.48 117.43 0.55 Allowed Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.455 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -67.51 -25.69 65.97 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.18 -28.25 57.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.325 -0.859 . . . . 0.0 110.214 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -113.09 35.47 3.92 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.355 -0.841 . . . . 0.0 110.221 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -166.13 -52.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.28 -0.888 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.22 -21.93 77.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.7 tp -58.4 -25.58 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.299 -1.118 . . . . 0.0 110.409 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -124.18 74.27 1.29 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.342 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 p -153.64 58.83 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 91.7 m -157.52 125.22 5.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.366 -0.834 . . . . 0.0 110.216 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.15 -74.46 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.2 p -145.4 69.59 1.24 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.358 -1.083 . . . . 0.0 110.272 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -83.67 60.74 5.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.312 -0.868 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -82.65 -57.42 3.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.182 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 60.4 m -126.05 89.83 3.09 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.429 -0.795 . . . . 0.0 110.161 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.12 -32.27 73.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 110.252 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -90.32 -36.94 14.37 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.11 -39.75 32.86 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.352 -0.843 . . . . 0.0 110.289 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -92.57 -18.61 22.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.385 -0.822 . . . . 0.0 110.595 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.37 -55.49 30.14 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -108.91 126.33 52.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -1.074 . . . . 0.0 110.105 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 9.28 43.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 110.567 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.84 57.89 4.05 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.59 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -161.47 41.84 0.09 OUTLIER Pre-proline 0 C--N 1.307 -1.279 0 O-C-N 121.424 -1.045 . . . . 0.0 110.274 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 46.3 Cg_endo -70.05 -10.16 27.7 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 N-CA-C 108.532 -1.372 . . . . 0.0 108.532 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.7 101.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.827 -0.546 . . . . 0.0 110.431 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.7 mt -91.08 -38.14 12.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.39 -0.819 . . . . 0.0 110.179 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.8 m -70.27 -11.65 61.05 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.562 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.6 m -92.98 -24.83 18.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.297 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.409 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 36.4 mtm -84.19 124.23 30.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.178 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -78.23 -165.45 0.68 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.459 -0.775 . . . . 0.0 110.591 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.6 pt-20 -65.75 -31.31 72.23 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.442 -0.786 . . . . 0.0 109.248 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.461 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 46.5 mt-10 -84.64 -41.2 16.58 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -62.74 -45.93 90.45 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.409 ' HG3' ' HB3' ' A' ' 87' ' ' MET . 79.6 mt-30 -65.2 -36.28 83.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.493 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 98' ' ' GLN . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.428 ' CZ ' ' HE1' ' A' ' 99' ' ' MET . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.499 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . -83.0 -32.15 27.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.408 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 7.4 mtt -83.7 -24.21 31.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.366 -0.834 . . . . 0.0 110.094 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.409 ' CB ' ' O ' ' A' ' 94' ' ' ALA . 8.3 tp60 -82.28 -36.22 27.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.412 -0.805 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.428 ' HE1' ' CZ ' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -82.9 -24.18 33.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.875 . . . . 0.0 110.312 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.6 m -82.26 -28.31 31.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.354 -0.841 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 6.5 mt -93.33 15.85 14.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -107.85 -27.54 10.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.93 . . . . 0.0 110.154 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -79.3 -77.62 0.9 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.71 75.34 0.84 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.293 -1.121 . . . . 0.0 110.136 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -65.76 -68.19 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.294 -0.879 . . . . 0.0 110.333 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.89 -48.21 0.8 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.31 -0.869 . . . . 0.0 110.078 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.47 -104.99 0.48 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -116.19 54.51 0.83 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.326 -1.103 . . . . 0.0 110.214 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.82 79.02 0.12 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.362 -0.836 . . . . 0.0 110.478 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -106.79 50.68 0.76 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 110.121 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.2 p -68.28 109.92 3.82 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.189 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.226 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.444 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.444 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.499 HG12 ' HB2' ' A' ' 96' ' ' ALA . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.408 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.402 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.448 ' CD2' HD21 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.493 HG23 HD12 ' B' ' 61' ' ' ILE . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.412 HG12 ' N ' ' B' ' 71' ' ' LEU . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.412 ' N ' HG12 ' B' ' 70' ' ' VAL . 12.7 mt -94.07 117.03 29.52 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 18.5 ttt-85 -90.26 100.56 13.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.279 -0.888 . . . . 0.0 110.157 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mp -71.33 -173.07 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -164.6 95.9 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.287 -0.883 . . . . 0.0 110.312 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.32 -65.86 3.0 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 117.996 -1.447 . . . . 0.0 109.579 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.146 0.498 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtp -60.86 -178.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.428 -0.795 . . . . 0.0 110.259 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.72 23.62 13.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.748 . . . . 0.0 109.56 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.3 -8.18 78.49 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.7 -33.32 66.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -1.223 . . . . 0.0 110.269 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -96.37 130.86 10.41 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 10.46 22.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.446 -1.032 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 p -113.16 -18.58 12.09 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.916 . . . . 0.0 110.296 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.74 -24.04 55.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.899 . . . . 0.0 110.43 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 31.1 p90 -160.8 119.55 2.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 0.0 110.314 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.27 66.83 1.53 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.475 -0.765 . . . . 0.0 110.032 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 52.65 36.56 21.18 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.291 -0.88 . . . . 0.0 110.428 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.79 17.12 3.26 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -129.53 -26.45 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -1.091 . . . . 0.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.542 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -56.48 -178.7 0.07 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.293 -0.88 . . . . 0.0 110.277 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.542 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 37.2 Cg_endo -62.01 79.91 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.601 1.316 . . . . 0.0 110.497 -178.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.1 45.98 0.66 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.321 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.51 27.62 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.145 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -161.43 105.33 1.21 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.087 -1.008 . . . . 0.0 110.54 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.433 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.14 -24.68 64.12 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.33 -28.93 24.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.308 -0.87 . . . . 0.0 110.161 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -87.6 100.22 12.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.384 -0.822 . . . . 0.0 110.274 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.38 32.32 13.61 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.516 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.39 -37.18 0.65 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 11.3 tt -66.87 79.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -1.071 . . . . 0.0 110.267 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.55 132.01 56.76 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.254 -0.904 . . . . 0.0 110.197 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -76.2 -172.04 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.404 -0.81 . . . . 0.0 110.252 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.6 p -74.65 103.2 4.85 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.327 -0.858 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.88 -112.17 1.08 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.3 m -154.45 74.67 0.96 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.272 -1.134 . . . . 0.0 110.301 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -139.77 43.7 1.96 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.51 -42.64 5.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.5 m -102.93 70.1 1.07 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.427 -0.796 . . . . 0.0 110.161 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -77.68 -60.72 2.25 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.267 -0.895 . . . . 0.0 110.184 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.97 -42.21 15.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 76' ' ' PHE . 15.0 pt-20 -64.15 -37.98 89.41 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.256 -0.903 . . . . 0.0 110.09 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.416 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 61.8 t80 -82.56 -29.62 30.19 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.462 -0.774 . . . . 0.0 110.188 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.8 -35.21 84.76 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.3 mtt180 -105.9 -24.0 12.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -1.098 . . . . 0.0 110.445 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.5 m 52.33 25.66 3.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.239 -0.913 . . . . 0.0 110.136 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.454 ' C ' ' HG ' ' A' ' 81' ' ' LEU . . . 99.97 -92.53 1.13 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.454 ' HG ' ' C ' ' A' ' 80' ' ' GLY . 95.6 mt -153.08 143.27 15.38 Favored Pre-proline 0 N--CA 1.487 1.397 0 O-C-N 121.582 -0.952 . . . . 0.0 108.456 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -75.84 50.15 2.69 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.512 1.27 . . . . 0.0 110.359 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -59.04 119.43 7.26 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 43.9 mt -80.05 -29.32 39.21 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.385 -0.822 . . . . 0.0 110.155 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -61.26 -32.22 72.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -0.826 . . . . 0.0 110.132 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m -84.1 -27.94 27.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.286 -0.884 . . . . 0.0 109.998 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.6 mtt -81.24 119.18 23.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.449 -0.782 . . . . 0.0 110.008 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.432 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 75.6 p -74.55 -168.08 0.64 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.467 -0.771 . . . . 0.0 110.382 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.561 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -67.11 -28.34 68.08 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.529 -0.732 . . . . 0.0 109.237 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.459 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.7 mt-10 -85.4 -41.75 15.15 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.432 ' HB2' ' N ' ' A' ' 88' ' ' THR . 5.1 mm-40 -63.73 -42.96 97.8 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -68.52 -33.8 74.76 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.561 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.435 ' CD2' HD22 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.517 ' HB3' HG12 ' B' ' 44' ' ' ILE . . . -76.58 -33.16 58.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 55.5 mtt -79.27 -23.24 43.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.313 -0.867 . . . . 0.0 109.661 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -81.84 -26.53 34.2 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.471 -0.768 . . . . 0.0 110.177 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' MET . . . . . 0.425 ' HE2' ' CE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -94.11 -21.77 18.91 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.354 -0.841 . . . . 0.0 110.34 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m -87.1 -23.32 24.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.401 -0.812 . . . . 0.0 110.147 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 7.5 tp -86.87 8.88 21.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.367 -0.833 . . . . 0.0 110.523 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.07 34.95 1.73 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.64 74.63 0.38 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.8 93.86 1.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.37 -1.077 . . . . 0.0 110.335 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -107.92 -50.17 3.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.327 -0.858 . . . . 0.0 110.124 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 60.59 38.97 18.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.398 -0.814 . . . . 0.0 109.95 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.72 120.84 24.53 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.85 88.3 3.16 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.377 -1.072 . . . . 0.0 110.276 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -170.54 123.25 0.65 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.321 -0.862 . . . . 0.0 110.233 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -64.53 -39.02 92.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.35 -0.844 . . . . 0.0 110.127 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -153.94 -58.04 0.12 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.884 . . . . 0.0 110.264 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.207 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.473 ' CE1' ' CG2' ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.435 HD22 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.401 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.473 ' CG2' ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.454 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.477 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.42 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.42 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.413 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.416 ' HB3' ' CD1' ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.517 HG12 ' HB3' ' A' ' 96' ' ' ALA . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.458 HD23 ' CD2' ' B' ' 59' ' ' TYR . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.477 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.458 ' CD2' HD23 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.423 HG22 HD13 ' B' ' 61' ' ' ILE . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.473 ' CG2' ' HB1' ' A' ' 96' ' ' ALA . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt -94.11 136.53 34.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -125.64 146.0 49.91 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.359 -0.838 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.99 162.31 23.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 110.129 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 76.23 10.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.411 -0.806 . . . . 0.0 110.19 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 167.24 -86.83 0.1 OUTLIER Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 117.956 -1.469 . . . . 0.0 109.559 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 4.8 m80 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.157 0.503 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mtp -165.55 -178.64 5.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.386 -0.821 . . . . 0.0 110.141 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.3 mp -112.27 24.28 12.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.621 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.94 67.67 3.64 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.78 -34.97 30.08 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.366 -1.079 . . . . 0.0 110.148 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.65 174.83 28.18 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.6 32.86 2.17 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.418 -1.048 . . . . 0.0 110.164 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.7 p -100.39 18.16 19.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.344 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.2 -22.88 35.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.256 -0.902 . . . . 0.0 110.194 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.418 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 37.4 p90 -166.68 121.47 1.11 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.799 . . . . 0.0 110.098 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -170.43 50.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.255 -0.903 . . . . 0.0 110.688 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.492 ' CD1' ' N ' ' A' ' 13' ' ' GLY . 53.5 p90 -153.45 -39.81 0.1 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.242 -0.911 . . . . 0.0 110.471 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.492 ' N ' ' CD1' ' A' ' 12' ' ' PHE . . . -131.01 34.6 2.6 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 54.1 t -110.36 -50.59 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.412 -1.052 . . . . 0.0 110.311 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.534 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -64.99 178.7 0.47 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.534 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 36.4 Cg_endo -59.85 77.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.702 1.37 . . . . 0.0 111.23 -178.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 67.88 45.17 1.43 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.728 0.775 . . . . 0.0 108.945 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 40.23 31.14 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.127 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -160.28 111.51 1.39 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.294 -0.879 . . . . 0.0 110.478 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.408 ' CB ' ' CG ' ' A' ' 16' ' ' PRO . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.9 -27.69 57.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.03 -10.85 59.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.357 -0.84 . . . . 0.0 110.537 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -95.69 76.07 3.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.185 -0.947 . . . . 0.0 110.28 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.32 25.98 3.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.535 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 21.96 4.23 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.4 tp -78.24 -31.47 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -1.137 . . . . 0.0 110.329 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -96.06 -59.24 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.349 -0.844 . . . . 0.0 110.103 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 37.2 p -134.28 179.96 5.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.371 -0.83 . . . . 0.0 110.195 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.0 p -100.07 128.62 46.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.306 -0.871 . . . . 0.0 110.168 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -145.74 70.2 0.37 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.3 p -71.8 69.87 0.69 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.37 -1.076 . . . . 0.0 110.178 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -107.66 52.08 0.72 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.848 . . . . 0.0 110.23 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -98.31 -32.5 11.5 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.254 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.81 77.61 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.339 -0.851 . . . . 0.0 110.248 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -77.81 -58.34 3.32 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.359 -0.838 . . . . 0.0 110.269 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -78.36 -46.65 19.46 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -64.67 -39.27 93.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.432 -0.793 . . . . 0.0 109.965 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.5 t80 53.75 -92.3 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.474 -0.766 . . . . 0.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.1 37.69 86.91 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.35 103.37 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -1.047 . . . . 0.0 110.392 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.1 m -145.81 40.49 1.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.371 -0.831 . . . . 0.0 110.264 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.39 57.21 5.07 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.6 mp -157.79 149.44 17.05 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 121.43 -1.041 . . . . 0.0 108.511 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.57 35.72 0.52 Allowed 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.438 1.23 . . . . 0.0 110.975 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.76 63.38 2.25 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.067 -1.021 . . . . 0.0 110.677 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.16 -47.65 70.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.414 -0.804 . . . . 0.0 110.199 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.52 -3.05 28.56 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 110.683 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.84 -3.84 14.79 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.167 -0.958 . . . . 0.0 110.283 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.9 mtm -85.18 -164.55 1.01 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.243 -0.91 . . . . 0.0 109.96 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.8 p -127.74 -179.81 5.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.308 -0.87 . . . . 0.0 110.518 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.619 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.72 -29.72 70.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.567 -0.708 . . . . 0.0 109.268 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.47 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.3 mt-10 -82.5 -42.33 18.57 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -43.02 99.88 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -70.02 -33.99 72.72 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.619 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.414 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.75 -32.3 72.8 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 mtp -74.89 -20.56 59.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -79.62 -28.4 40.94 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.515 -0.741 . . . . 0.0 109.988 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 61.2 mtm -102.98 0.87 32.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.45 -0.781 . . . . 0.0 110.629 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 10.8 t -112.81 -17.13 12.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.178 -0.951 . . . . 0.0 110.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -26.14 64.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 110.311 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -69.75 -57.36 5.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.422 -0.799 . . . . 0.0 110.145 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.69 114.53 3.73 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.47 92.7 3.95 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.43 -1.041 . . . . 0.0 110.163 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -80.0 -56.0 4.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.425 -0.797 . . . . 0.0 110.241 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -163.02 -44.36 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.361 -0.837 . . . . 0.0 110.187 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.06 54.74 0.75 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -69.82 74.66 0.44 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.353 -1.087 . . . . 0.0 110.203 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.24 88.38 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.296 -0.878 . . . . 0.0 110.465 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -122.47 -56.56 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.29 -0.881 . . . . 0.0 110.276 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -100.07 56.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.189 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.414 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.401 ' O ' HD12 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.455 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . 0.412 ' CG2' HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.446 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.446 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.411 HG23 HD12 ' B' ' 44' ' ' ILE . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.437 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.455 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.507 ' CD1' ' N ' ' B' ' 56' ' ' LEU . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.416 HG21 HD12 ' B' ' 61' ' ' ILE . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.456 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.45 134.9 36.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.18 129.34 56.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.312 -0.868 . . . . 0.0 110.088 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -90.96 135.1 33.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 110.323 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.58 76.14 6.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.356 -0.84 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 113.13 142.45 8.35 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.956 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.511 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -163.66 -177.91 5.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.424 -0.798 . . . . 0.0 110.177 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.78 25.23 11.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.447 -0.783 . . . . 0.0 109.656 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.22 -125.44 1.03 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.9 mt -127.54 -48.08 1.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.375 -1.074 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.61 24.34 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.71 -33.55 5.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.422 -1.046 . . . . 0.0 110.198 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -86.08 3.04 44.24 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.335 -0.853 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.27 -27.02 24.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.182 -0.949 . . . . 0.0 110.22 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -137.86 106.93 6.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.355 -0.841 . . . . 0.0 110.226 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -131.38 50.97 2.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.44 -0.788 . . . . 0.0 110.275 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -128.8 -63.57 0.96 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.221 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.93 25.18 3.74 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.8 t -118.19 -23.28 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.41 -1.053 . . . . 0.0 110.405 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.545 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -59.36 -179.31 0.15 Allowed Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.309 -0.87 . . . . 0.0 110.132 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.545 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 36.8 Cg_endo -60.71 78.39 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.271 0 O-C-N 123.542 1.285 . . . . 0.0 111.034 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.465 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 68.86 44.78 1.05 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.819 0.819 . . . . 0.0 108.964 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.74 27.83 0.07 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.332 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.75 110.22 0.47 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.988 . . . . 0.0 110.53 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.415 ' CB ' ' HB2' ' A' ' 16' ' ' PRO . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.1 -38.34 66.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.52 70.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.863 . . . . 0.0 110.137 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.13 84.15 5.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.384 -0.823 . . . . 0.0 110.14 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 54.19 27.69 8.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.361 -0.837 . . . . 0.0 110.344 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -114.56 -15.55 8.08 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 54' ' ' ILE . 0.1 OUTLIER -58.2 -34.8 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.182 -1.187 . . . . 0.0 110.157 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.93 97.75 1.48 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.331 -0.856 . . . . 0.0 110.138 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 27.0 p -120.9 124.85 45.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 0.0 110.24 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.6 p -153.41 112.87 3.82 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.353 -0.842 . . . . 0.0 110.287 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.84 -56.97 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.7 t -154.52 56.36 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.365 -1.079 . . . . 0.0 110.204 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -98.94 60.67 1.24 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.389 -0.819 . . . . 0.0 110.145 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -94.21 -40.32 10.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.359 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.4 m -126.59 95.31 4.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.345 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.36 -30.27 68.28 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.332 -0.855 . . . . 0.0 110.084 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -79.57 -42.96 23.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.05 -38.99 92.63 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.318 -0.864 . . . . 0.0 110.028 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -83.99 -31.46 25.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.367 -0.833 . . . . 0.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.36 64.15 1.73 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 50.68 69.96 0.57 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.362 -1.081 . . . . 0.0 110.774 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.0 t -49.73 -29.83 8.3 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.913 0.863 . . . . 0.0 109.367 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.436 ' O ' HD23 ' A' ' 81' ' ' LEU . . . -165.49 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.485 1.944 0 N-CA-C 107.988 -2.045 . . . . 0.0 107.988 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.436 HD23 ' O ' ' A' ' 80' ' ' GLY . 61.3 mt -155.91 148.6 17.97 Favored Pre-proline 0 N--CA 1.486 1.346 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.83 36.21 0.55 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 123.47 1.247 . . . . 0.0 110.876 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 50.86 86.84 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.175 -0.953 . . . . 0.0 110.654 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.46 -31.56 48.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.035 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -22.27 66.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 110.245 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -86.56 -26.52 24.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 37.8 mtt -69.42 118.93 12.92 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.865 . . . . 0.0 109.98 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -78.36 -160.74 0.22 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.496 -0.753 . . . . 0.0 110.68 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mt-10 -69.07 -33.3 73.32 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.495 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.2 mp0 -85.92 -36.81 19.66 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.283 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.67 -45.46 86.64 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 178.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.411 ' HB3' HG11 ' B' ' 70' ' ' VAL . 58.0 mt-30 -68.36 -34.53 76.24 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.557 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.497 ' HB1' HG12 ' B' ' 44' ' ' ILE . . . -70.02 -43.02 72.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 29.5 mtt -78.29 -13.12 59.99 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.395 -0.816 . . . . 0.0 110.08 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.74 -49.07 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 6.1 mtm -78.59 -16.5 57.33 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.385 -0.822 . . . . 0.0 110.649 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.7 m -87.32 -29.14 21.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 0.0 110.186 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.45 -24.13 64.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.34 -0.85 . . . . 0.0 110.05 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.61 36.47 2.62 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.443 -0.786 . . . . 0.0 110.066 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.78 -82.06 0.92 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -140.11 94.99 2.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.452 -1.028 . . . . 0.0 110.237 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -153.7 82.08 1.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.306 -0.871 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -137.21 -64.17 0.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.43 -0.794 . . . . 0.0 110.285 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.29 -44.92 0.78 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -123.43 93.18 3.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.393 -1.063 . . . . 0.0 110.32 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.53 -67.86 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -93.05 -34.12 13.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.407 -0.808 . . . . 0.0 110.259 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -96.21 176.06 6.22 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.187 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.215 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.46 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' B' ' 14' ' ' THR . 0.2 OUTLIER -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.431 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.431 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.401 ' CG2' ' NE2' ' B' ' 2' ' ' GLN . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.46 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.461 HD12 HG23 ' B' ' 23' ' ' ILE . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.402 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.531 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.497 HG12 ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.435 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.427 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.435 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt -93.69 130.78 39.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . 0.401 ' HA ' ' CG ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -103.76 89.11 3.22 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.441 -0.787 . . . . 0.0 110.035 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.25 172.41 0.62 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.268 -0.895 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.8 33.27 2.6 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.449 -0.782 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.45 -167.19 38.1 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.013 -1.437 . . . . 0.0 109.575 179.952 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.057 0.456 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.6 mtp 53.23 -179.86 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.265 -0.897 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.51 24.77 12.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.418 -0.801 . . . . 0.0 109.627 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.63 -34.73 8.99 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -107.86 75.3 0.99 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.372 -1.075 . . . . 0.0 110.287 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -129.14 -97.82 0.86 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.96 70.33 1.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.373 -1.075 . . . . 0.0 110.255 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.8 p -156.81 -43.93 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.352 -0.842 . . . . 0.0 110.242 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -69.55 -30.04 67.76 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.442 -0.786 . . . . 0.0 110.113 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.33 103.17 6.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.429 -0.794 . . . . 0.0 110.071 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -108.6 39.36 2.02 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.384 -0.823 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -136.06 15.16 3.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.348 -0.845 . . . . 0.0 110.554 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.67 49.97 55.67 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.9 m -51.54 -25.81 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.432 -1.04 . . . . 0.0 110.425 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -135.43 145.86 55.41 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.998 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.65 -15.79 30.31 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.645 1.339 . . . . 0.0 110.771 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -72.55 -6.29 42.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.299 -0.876 . . . . 0.0 110.703 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 21.42 13.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.114 -0.991 . . . . 0.0 110.337 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.55 118.51 0.56 Allowed Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.289 -0.882 . . . . 0.0 109.853 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.443 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.69 -25.1 41.32 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.88 -18.42 22.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.31 -0.868 . . . . 0.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -112.01 -42.39 3.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.189 -0.944 . . . . 0.0 110.305 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.67 -31.62 18.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.345 -0.847 . . . . 0.0 110.31 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -118.27 51.27 0.76 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.6 tt -68.3 75.46 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.332 -1.099 . . . . 0.0 110.253 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -154.63 154.12 32.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.297 -0.877 . . . . 0.0 110.079 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 13.3 p -107.55 103.19 12.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.408 -0.808 . . . . 0.0 110.288 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.6 p -104.06 97.69 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.336 -0.853 . . . . 0.0 110.119 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.8 76.69 0.22 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.6 p -85.34 73.9 10.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.415 -1.05 . . . . 0.0 110.135 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 62' ' ' SER . 1.2 mt-10 -102.27 43.62 1.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.432 -0.793 . . . . 0.0 110.5 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.617 ' O ' ' N ' ' A' ' 63' ' ' ASP . 20.7 m-20 -55.74 97.17 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.417 ' N ' ' O ' ' A' ' 60' ' ' GLU . 1.0 OUTLIER -50.98 78.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.637 0.732 . . . . 0.0 110.85 -177.794 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.617 ' N ' ' O ' ' A' ' 61' ' ' ASP . 5.0 t0 -77.75 -56.95 4.09 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.673 -0.642 . . . . 0.0 110.1 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.51 -34.71 31.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -66.0 -53.21 41.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.372 -0.83 . . . . 0.0 110.18 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -61.54 -30.88 70.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.07 -36.76 45.21 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.98 123.06 27.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -1.106 . . . . 0.0 110.124 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -144.79 42.36 1.33 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.452 -0.78 . . . . 0.0 110.272 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -102.4 27.68 19.25 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -174.81 152.29 1.55 Allowed Pre-proline 0 N--CA 1.488 1.428 0 O-C-N 121.319 -1.106 . . . . 0.0 108.901 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.87 0.6 Allowed 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.595 1.313 . . . . 0.0 110.885 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.3 t0 50.71 63.51 2.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.143 -0.973 . . . . 0.0 110.609 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.7 tp -61.93 -34.81 76.77 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.348 -0.845 . . . . 0.0 110.256 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.1 p -60.44 -25.79 66.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.315 -0.866 . . . . 0.0 110.398 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 p -83.76 -23.27 31.61 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.391 -0.818 . . . . 0.0 110.058 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 15.9 mtt -82.02 118.45 23.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.359 -0.838 . . . . 0.0 109.866 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -76.42 -167.54 0.81 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.382 -0.823 . . . . 0.0 110.621 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.555 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.3 pt-20 -66.57 -29.73 69.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.548 -0.72 . . . . 0.0 109.157 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.465 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 47.4 mt-10 -85.32 -41.83 15.15 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -46.07 89.93 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -66.24 -34.21 77.49 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.555 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.451 ' CD2' HD11 ' B' ' 8' ' ' LEU . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.52 -27.96 61.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 3.0 ttt -81.22 -24.22 37.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.757 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -81.82 -23.91 36.21 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 110.36 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 20.0 mmm -94.0 -18.44 21.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.244 -0.91 . . . . 0.0 110.484 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.6 p -92.99 -23.37 18.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.653 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -71.13 -9.66 58.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.229 -0.919 . . . . 0.0 110.625 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -65.8 -45.86 80.82 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.172 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.08 113.63 0.72 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -91.39 82.05 5.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.372 -1.075 . . . . 0.0 110.267 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -92.58 -27.89 17.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.396 -0.815 . . . . 0.0 110.112 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -94.35 17.84 12.17 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.0 110.427 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.52 83.17 0.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -104.29 81.65 1.85 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.379 -1.071 . . . . 0.0 110.28 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -91.13 -34.86 14.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -155.86 -52.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.336 -0.853 . . . . 0.0 110.252 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -147.59 136.63 22.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.375 -0.828 . . . . 0.0 110.254 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.158 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.451 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.446 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.417 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.417 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.428 HD23 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.446 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.431 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.431 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.44 HD11 HG23 ' B' ' 61' ' ' ILE . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.42 HG11 ' N ' ' B' ' 71' ' ' LEU . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.42 ' N ' HG11 ' B' ' 70' ' ' VAL . 20.4 mt -93.22 131.8 37.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -112.34 157.52 20.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -122.12 156.06 34.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 110.141 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.83 156.38 43.53 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.337 -0.852 . . . . 0.0 110.248 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.2 -48.89 1.93 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 118.001 -1.444 . . . . 0.0 109.572 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.194 0.521 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttp -88.54 -177.06 5.51 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.384 -0.822 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.77 25.5 11.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.437 -0.79 . . . . 0.0 109.538 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 64.8 4.12 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mt -139.21 60.38 1.59 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.29 -1.124 . . . . 0.0 110.273 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.72 -128.38 0.1 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.01 -46.1 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.397 -1.061 . . . . 0.0 110.185 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.9 p -63.37 -27.37 69.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.35 -0.844 . . . . 0.0 110.175 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.1 -11.48 60.32 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.377 -0.827 . . . . 0.0 110.49 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -139.56 95.14 2.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.0 110.313 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -168.22 34.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.343 -0.848 . . . . 0.0 110.236 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.32 -44.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.455 -0.778 . . . . 0.0 110.077 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -106.75 29.01 11.47 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.6 t -106.47 -62.26 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 0.0 110.062 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -168.18 163.34 8.83 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.351 -0.843 . . . . 0.0 110.137 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.4 -19.5 28.73 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 O-C-N 123.772 1.406 . . . . 0.0 110.677 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -66.49 -13.9 61.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.336 -0.852 . . . . 0.0 110.512 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.27 62.47 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.251 -0.906 . . . . 0.0 110.48 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.88 118.7 0.61 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.267 -0.895 . . . . 0.0 109.902 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.415 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.415 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.92 -30.67 65.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.94 65.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.348 -0.845 . . . . 0.0 110.162 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -28.45 67.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.856 . . . . 0.0 110.173 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.62 21.16 10.17 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.458 -0.776 . . . . 0.0 110.22 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -127.35 -56.28 0.13 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.1 pp -148.39 80.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.274 -1.133 . . . . 0.0 110.273 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -98.5 121.41 40.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.29 -0.881 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -77.31 89.78 3.74 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.411 -0.805 . . . . 0.0 110.131 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.4 m -77.62 97.46 5.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.21 -116.51 1.52 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.5 t -165.88 102.86 0.67 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.381 -1.07 . . . . 0.0 110.224 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -118.39 90.43 3.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.316 -0.865 . . . . 0.0 110.131 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -80.95 -42.49 21.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.383 -0.823 . . . . 0.0 110.262 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 17.0 m -122.96 81.63 1.89 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.363 -0.836 . . . . 0.0 110.261 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.31 -31.62 71.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.305 -0.872 . . . . 0.0 110.111 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -97.46 -27.47 14.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -112.81 -22.22 10.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.0 t80 52.91 58.32 5.46 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.209 -0.932 . . . . 0.0 110.436 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -86.68 -54.61 2.61 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.34 117.5 32.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -1.083 . . . . 0.0 110.155 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.0 m -153.38 31.69 0.47 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.422 -0.799 . . . . 0.0 110.313 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.66 36.1 4.22 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.08 153.06 1.54 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.411 -1.052 . . . . 0.0 108.909 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -76.71 38.45 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.539 1.284 . . . . 0.0 110.965 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.7 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.057 -1.027 . . . . 0.0 110.655 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -86.1 -29.91 22.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.415 -0.803 . . . . 0.0 110.073 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -65.18 -15.88 62.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.295 -0.878 . . . . 0.0 110.359 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.2 m -90.68 -22.87 20.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.7 mtt -88.47 123.93 33.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.828 . . . . 0.0 110.071 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.5 p -78.29 -164.49 0.56 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.36 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.486 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.6 pt-20 -67.25 -31.3 71.55 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.439 -0.788 . . . . 0.0 109.393 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.488 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.6 mt-10 -85.47 -40.22 16.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -63.39 -45.08 92.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -67.28 -34.52 77.57 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.488 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.421 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.62 -36.91 51.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 ttm -76.35 -23.52 54.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.529 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -79.84 -26.17 40.53 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.495 -0.753 . . . . 0.0 110.034 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.1 ttp -96.09 -8.03 34.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.371 -0.831 . . . . 0.0 110.435 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.472 ' HB2' ' CD2' ' B' ' 68' ' ' HIS . 1.3 t -100.01 -21.85 15.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.254 -0.904 . . . . 0.0 110.433 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -19.46 45.99 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.254 -0.904 . . . . 0.0 110.14 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -98.91 51.02 0.96 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.235 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.22 -109.36 0.01 OUTLIER Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.78 84.47 6.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.383 -1.069 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.6 -74.71 0.2 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -168.97 -58.43 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.23 -32.15 2.6 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -100.68 65.23 1.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.43 -1.041 . . . . 0.0 110.251 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.26 70.14 0.1 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.39 -0.818 . . . . 0.0 110.226 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 53.03 30.83 10.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.304 -0.872 . . . . 0.0 110.482 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.1 t -107.5 -36.11 6.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.414 -0.804 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.192 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.429 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.421 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.425 HD13 HG22 ' B' ' 23' ' ' ILE . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.404 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.436 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.436 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 10.2 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.409 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.461 HD22 ' CD2' ' B' ' 59' ' ' TYR . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.417 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.461 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.448 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.448 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.472 ' CD2' ' HB2' ' A' ' 100' ' ' SER . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.431 HG12 ' N ' ' B' ' 71' ' ' LEU . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.431 ' N ' HG12 ' B' ' 70' ' ' VAL . 88.8 mt -94.05 127.84 40.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -110.77 105.28 14.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.49 137.14 41.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.368 -0.832 . . . . 0.0 110.241 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -77.28 75.47 3.84 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.819 . . . . 0.0 110.072 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 71.77 -71.4 0.9 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.533 -179.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 t60 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.243 0.544 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 52.91 -174.95 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.32 -0.862 . . . . 0.0 110.389 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.7 mp -112.69 25.85 11.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.335 -0.853 . . . . 0.0 109.618 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.0 -35.07 25.32 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.2 79.2 0.7 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.385 -1.068 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -124.91 41.14 1.75 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.29 -43.73 15.71 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -1.047 . . . . 0.0 110.177 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.4 t -61.64 -27.68 68.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.345 -0.847 . . . . 0.0 110.143 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.04 -28.26 66.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.335 -0.853 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -152.12 78.01 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.798 . . . . 0.0 110.175 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.77 113.9 20.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.381 -0.824 . . . . 0.0 110.386 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 51.92 29.25 5.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.324 -0.86 . . . . 0.0 110.501 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -119.63 25.8 7.51 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 28.9 m -118.76 -20.78 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.288 -1.125 . . . . 0.0 110.525 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -125.39 150.43 67.54 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.227 -0.921 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.65 -20.75 26.31 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.653 1.344 . . . . 0.0 110.744 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 25.7 p -70.48 -5.06 25.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.285 -0.884 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.59 19.23 4.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -169.66 121.11 0.6 Allowed Pre-proline 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 0.0 109.835 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.441 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.73 -34.0 71.44 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.69 16.22 24.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.478 -0.763 . . . . 0.0 110.319 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.14 -62.44 1.59 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.925 . . . . 0.0 110.07 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.46 22.06 15.51 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.426 -0.796 . . . . 0.0 110.156 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.59 -29.68 6.16 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.7 pt -72.28 63.99 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.376 -1.073 . . . . 0.0 110.175 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -165.6 113.63 0.97 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.408 -0.808 . . . . 0.0 110.139 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.3 t -117.13 -170.29 1.81 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.393 -0.817 . . . . 0.0 110.339 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 31.4 p -148.83 169.58 20.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.301 -0.874 . . . . 0.0 110.167 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -167.1 33.83 0.21 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.8 m -104.58 79.39 1.55 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.369 -1.077 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -99.58 66.43 1.44 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.91 -35.13 14.2 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -108.2 73.1 0.87 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.381 -0.824 . . . . 0.0 110.111 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.08 -40.05 68.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.318 -0.864 . . . . 0.0 110.414 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.412 ' CG2' ' O ' ' A' ' 66' ' ' LEU . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.412 ' N ' ' CG2' ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.24 -40.88 16.13 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -75.45 -42.32 53.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -104.05 94.41 5.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.41 -0.806 . . . . 0.0 110.213 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.37 86.27 0.08 OUTLIER Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 52.74 95.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.387 -1.066 . . . . 0.0 110.471 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -123.44 29.43 6.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.359 -0.838 . . . . 0.0 110.193 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.79 31.5 7.81 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.9 149.77 9.45 Favored Pre-proline 0 N--CA 1.486 1.345 0 O-C-N 121.54 -0.976 . . . . 0.0 108.689 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -76.93 38.45 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.806 0 O-C-N 123.511 1.269 . . . . 0.0 110.912 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.06 44.96 28.41 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.629 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.44 -49.99 73.26 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.31 -0.869 . . . . 0.0 110.098 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.7 m -71.88 -11.87 61.0 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.341 -0.85 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.1 t -102.04 -18.88 15.41 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.245 -0.909 . . . . 0.0 109.944 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 13.3 mtm -81.42 -162.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.404 -0.81 . . . . 0.0 109.845 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -144.49 -173.54 4.07 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.874 . . . . 0.0 110.344 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.572 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -64.71 -33.1 75.15 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.516 -0.74 . . . . 0.0 109.323 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.422 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 mt-10 -85.29 -41.74 15.26 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.556 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.58 -44.89 92.74 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -67.42 -34.12 76.57 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 178.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.572 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.426 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.487 ' HB3' HG12 ' B' ' 44' ' ' ILE . . . -79.04 -37.56 38.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 37.0 mtt -80.32 -21.26 42.72 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.786 . . . . 0.0 109.92 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -80.6 -39.26 27.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.325 -0.86 . . . . 0.0 110.276 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 28.3 mmm -83.91 -26.76 29.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.382 -0.824 . . . . 0.0 110.408 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -77.14 -33.91 56.64 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.259 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 28.2 mt -63.77 -21.23 66.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.291 -0.88 . . . . 0.0 110.34 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.92 50.87 0.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.346 -0.846 . . . . 0.0 110.165 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -110.66 69.49 0.21 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.73 99.44 0.89 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.358 -1.084 . . . . 0.0 110.229 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -104.35 -64.94 1.06 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.449 -0.782 . . . . 0.0 110.248 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.27 87.63 1.4 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.281 -0.887 . . . . 0.0 110.193 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -102.42 -34.94 4.0 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.11 53.77 2.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.331 -1.099 . . . . 0.0 110.154 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.19 -47.55 8.77 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.328 -0.858 . . . . 0.0 110.14 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -121.1 -52.13 2.09 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.372 -0.83 . . . . 0.0 110.086 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 79.7 p -88.88 138.41 31.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.28 -0.887 . . . . 0.0 110.278 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.178 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.446 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.426 ' HA ' ' CE2' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.461 HD13 HG22 ' B' ' 13' ' ' ILE . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.409 HG13 ' HB3' ' B' ' 50' ' ' LEU . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.487 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.487 HG12 ' HB3' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.459 ' CD2' ' CG ' ' B' ' 59' ' ' TYR . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.459 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . . . . . . . . . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.76 120.27 34.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -91.24 70.71 6.17 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.08 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.45 119.49 13.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.34 -0.85 . . . . 0.0 110.247 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.14 150.2 29.79 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.287 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 74.83 -93.35 0.84 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.022 -1.432 . . . . 0.0 109.547 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.219 0.533 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.26 -178.5 3.67 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.313 -0.867 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -111.88 24.23 12.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.496 -0.753 . . . . 0.0 109.577 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.35 -48.02 4.16 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 tt -167.28 104.13 0.53 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.339 -1.095 . . . . 0.0 110.176 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.76 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.73 51.45 0.99 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.345 -1.091 . . . . 0.0 110.293 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 m -154.98 26.41 0.43 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.419 -0.801 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -111.83 -11.53 13.92 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -166.95 37.24 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.275 -0.89 . . . . 0.0 110.348 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -79.07 60.01 2.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.38 -0.825 . . . . 0.0 110.251 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -169.44 -57.46 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.338 -0.851 . . . . 0.0 110.209 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -109.88 49.2 0.87 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 p -117.43 -24.63 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.404 -1.056 . . . . 0.0 110.402 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -138.91 148.78 59.31 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.07 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.82 -15.41 29.83 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.696 1.367 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 54.0 p -72.9 -6.81 47.63 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.146 -0.971 . . . . 0.0 110.66 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.65 17.51 16.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.026 -1.046 . . . . 0.0 110.409 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.67 119.96 0.58 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.794 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.42 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.79 -21.98 65.06 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.71 -12.29 61.25 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.897 . . . . 0.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.38 -51.06 66.01 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.48 22.8 11.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 110.287 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -111.32 -67.27 0.54 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 2.6 tp -102.76 58.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.337 -1.096 . . . . 0.0 110.185 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -120.45 -36.27 3.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.356 -0.84 . . . . 0.0 110.15 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 p -120.04 127.98 53.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.356 -0.84 . . . . 0.0 110.169 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 63.2 m -117.74 90.77 3.4 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.65 40.38 0.25 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 m -111.03 58.8 0.61 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.407 -1.055 . . . . 0.0 110.182 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -110.65 81.72 1.48 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.327 -0.858 . . . . 0.0 110.19 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.51 -41.49 3.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -0.849 . . . . 0.0 110.175 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.6 m -124.79 87.21 2.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.382 -0.824 . . . . 0.0 110.174 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.36 -29.74 66.23 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.251 -0.905 . . . . 0.0 110.233 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -81.66 -48.47 11.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.29 -45.43 94.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.324 -0.86 . . . . 0.0 110.103 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -88.51 106.6 18.39 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.428 -0.795 . . . . 0.0 110.211 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.4 -60.39 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -97.8 118.9 35.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.403 -1.057 . . . . 0.0 110.216 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -153.36 45.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.395 -0.815 . . . . 0.0 110.24 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -91.07 60.89 3.02 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 pp -172.54 147.47 1.7 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.31 -1.112 . . . . 0.0 108.886 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.09 64.24 2.59 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.599 1.315 . . . . 0.0 110.286 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -52.88 99.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.415 -0.803 . . . . 0.0 110.416 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.9 mp -76.8 -35.03 57.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.167 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.8 m -62.03 -17.99 59.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.337 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -107.71 -22.45 12.48 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.271 -0.893 . . . . 0.0 110.156 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.4 mtp -63.36 -165.09 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.007 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.8 p -141.43 -175.11 4.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.322 -0.861 . . . . 0.0 110.45 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.55 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.7 pt-20 -66.07 -31.37 72.21 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.558 -0.714 . . . . 0.0 109.295 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.45 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 58.2 mt-10 -83.23 -42.0 17.73 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -63.32 -43.88 96.52 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -67.27 -34.14 76.78 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.55 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.443 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . -65.42 -32.1 73.54 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 mtt -81.34 -24.04 37.36 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 109.948 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -80.43 -26.27 38.51 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.366 -0.834 . . . . 0.0 110.433 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -91.73 -21.76 20.55 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.387 -0.821 . . . . 0.0 110.495 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.8 p -87.12 -23.57 24.83 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.375 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 12.1 tp -83.69 3.36 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.334 -0.853 . . . . 0.0 110.708 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -159.53 27.13 0.19 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.203 -0.936 . . . . 0.0 110.31 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -83.72 -48.82 5.09 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.54 69.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.365 -1.08 . . . . 0.0 110.166 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 52.88 86.24 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.374 -0.828 . . . . 0.0 110.386 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.89 44.63 1.0 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.862 . . . . 0.0 110.214 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.58 39.79 2.63 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -128.8 102.64 6.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -1.064 . . . . 0.0 110.15 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.9 -17.44 18.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.414 -0.804 . . . . 0.0 110.414 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -92.02 44.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.251 -0.906 . . . . 0.0 110.368 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 2.7 t -169.44 -62.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.383 -0.823 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.199 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.44 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' B' ' 1' ' ' MET . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.475 HD13 HG23 ' B' ' 23' ' ' ILE . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.432 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.432 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.411 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.443 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.443 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.436 ' CD1' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.439 HD23 ' CD2' ' B' ' 59' ' ' TYR . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.439 ' CD2' HD23 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.478 HD13 HG21 ' B' ' 61' ' ' ILE . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.476 ' N ' ' CD2' ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . 0.443 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.43 ' CG2' ' HB1' ' A' ' 96' ' ' ALA . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.26 128.0 40.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 29.0 ttt-85 -99.4 106.93 19.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -0.872 . . . . 0.0 110.168 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mt -112.62 123.07 49.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 110.175 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -61.42 125.12 22.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.355 -0.841 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.69 151.14 6.11 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.039 -1.423 . . . . 0.0 109.58 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.246 0.546 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.1 mtp -119.51 -176.56 3.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.334 -0.854 . . . . 0.0 110.251 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mt -110.43 23.39 14.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.503 -0.748 . . . . 0.0 109.483 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.01 88.58 0.79 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 pp -94.58 21.52 7.19 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.438 -1.037 . . . . 0.0 110.484 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.93 178.04 43.02 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.35 37.27 3.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.407 -1.055 . . . . 0.0 110.232 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.1 m -109.13 -26.5 10.1 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.325 -0.86 . . . . 0.0 110.289 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -31.48 70.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.267 -0.896 . . . . 0.0 110.134 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -88.1 -10.27 50.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.436 -0.79 . . . . 0.0 110.555 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -58.86 91.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.276 -0.89 . . . . 0.0 110.312 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 52.61 31.27 9.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.297 -0.877 . . . . 0.0 110.359 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.35 -20.53 44.79 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 35.4 m -143.37 -41.1 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.138 -1.213 . . . . 0.0 110.677 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.509 ' CG ' ' HD2' ' A' ' 16' ' ' PRO . 0.0 OUTLIER -146.75 166.14 17.4 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.675 -179.637 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.509 ' HD2' ' CG ' ' A' ' 15' ' ' ASP . 34.8 Cg_endo -57.64 77.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.378 0 O-C-N 123.9 1.474 . . . . 0.0 111.45 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.487 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.4 t 68.03 41.23 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.463 0.649 . . . . 0.0 109.927 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.464 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.32 31.81 0.18 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.149 0.5 . . . . 0.0 110.786 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -161.73 115.26 1.24 Allowed Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.317 -0.864 . . . . 0.0 110.26 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.05 -40.52 96.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.89 -27.13 63.58 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.376 -0.827 . . . . 0.0 110.249 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -83.07 78.1 9.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.403 -0.811 . . . . 0.0 110.186 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.25 30.34 7.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.34 -0.85 . . . . 0.0 110.401 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.7 -59.23 1.08 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.9 tt -115.95 -18.37 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.371 -1.076 . . . . 0.0 110.435 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.83 164.62 17.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.218 -0.927 . . . . 0.0 110.182 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 m -67.92 157.91 33.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.346 -0.846 . . . . 0.0 110.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -143.13 174.83 10.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.296 -0.877 . . . . 0.0 110.329 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.35 -90.23 0.08 OUTLIER Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 m -151.77 104.36 3.02 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.369 -1.077 . . . . 0.0 110.202 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.04 73.59 1.37 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 110.191 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.69 -66.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.378 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.37 71.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.275 -0.89 . . . . 0.0 110.194 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -72.7 -39.76 66.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.33 -0.856 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -81.84 -38.17 25.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -72.86 -52.03 16.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.363 -0.836 . . . . 0.0 110.251 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.22 116.73 4.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.29 -0.881 . . . . 0.0 110.389 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.28 72.88 0.1 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.77 88.17 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.351 -1.088 . . . . 0.0 110.23 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.35 43.39 0.68 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.434 -0.791 . . . . 0.0 110.158 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -105.8 40.0 2.65 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.43 147.44 1.74 Allowed Pre-proline 0 N--CA 1.488 1.445 0 O-C-N 121.421 -1.046 . . . . 0.0 109.0 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -71.97 62.6 3.23 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.591 1.311 . . . . 0.0 110.231 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.71 110.32 0.87 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.382 -0.824 . . . . 0.0 110.386 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mp -84.73 -41.58 16.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.309 -0.87 . . . . 0.0 110.275 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 72.2 m -60.02 -31.34 69.86 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.402 -0.811 . . . . 0.0 110.214 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.5 m -84.71 -29.64 25.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.392 -0.818 . . . . 0.0 110.148 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 4.4 mtt -79.56 118.5 21.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.395 -0.815 . . . . 0.0 110.063 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.8 p -79.52 -162.19 0.39 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 110.546 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.4 pt-20 -67.89 -32.45 72.95 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.424 -0.798 . . . . 0.0 109.215 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.467 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 mt-10 -82.87 -40.03 20.79 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -64.47 -44.64 90.42 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -67.28 -33.52 75.48 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.499 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.435 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.501 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . -70.44 -39.32 74.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 43.7 mtt -78.41 -16.0 58.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.415 -0.803 . . . . 0.0 109.963 179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -41.45 25.93 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.378 -0.826 . . . . 0.0 110.469 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 86.4 mtp -85.06 -23.29 28.62 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.311 -0.868 . . . . 0.0 110.593 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 85.4 p -83.83 -25.17 30.56 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.32 -0.863 . . . . 0.0 110.269 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 13.5 tp -90.04 11.52 20.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.33 30.0 1.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.207 -0.933 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -96.61 -94.36 1.84 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.47 79.67 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.357 -1.084 . . . . 0.0 110.31 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -89.85 82.74 6.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -120.57 -65.66 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.353 -0.842 . . . . 0.0 110.206 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.76 148.62 12.93 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.45 62.68 0.78 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -1.082 . . . . 0.0 110.2 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.52 44.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.311 -0.868 . . . . 0.0 110.174 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -111.23 -50.31 2.95 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.352 -0.843 . . . . 0.0 110.265 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.9 p -162.29 56.19 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.146 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . 0.416 ' CE1' HG22 ' B' ' 14' ' ' THR . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.435 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' THR . . . . . 0.416 HG22 ' CE1' ' B' ' 4' ' ' PHE . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.423 HD11 HG23 ' B' ' 23' ' ' ILE . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.408 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.486 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.486 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.501 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.459 HD21 ' CD2' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.46 ' CE2' ' HB3' ' B' ' 54' ' ' ARG . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.435 HG21 HD13 ' B' ' 61' ' ' ILE . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.423 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.411 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt -94.15 111.64 23.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.45 67.04 5.09 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.86 158.64 32.12 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.407 -0.808 . . . . 0.0 110.216 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 141.68 32.88 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.343 -0.848 . . . . 0.0 110.171 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 65.53 147.6 0.06 OUTLIER Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.421 0 CA-C-O 118.018 -1.434 . . . . 0.0 109.525 -179.999 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -118.5 165.98 13.25 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.257 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.22 23.38 14.13 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.352 -0.842 . . . . 0.0 109.613 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.8 -63.42 2.72 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -149.53 22.18 0.92 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.463 ' O ' ' N ' ' A' ' 8' ' ' SER . . . -129.45 -103.02 1.05 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 65.22 -68.21 0.12 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.591 -0.946 . . . . 0.0 110.495 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 6' ' ' GLY . 0.4 OUTLIER -93.53 21.44 6.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 110.379 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.37 17.8 21.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.364 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -134.87 56.25 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' A' ' 15' ' ' ASP . 3.6 tt0 -97.4 126.08 42.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.381 -0.824 . . . . 0.0 109.973 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.407 ' CD1' HD22 ' A' ' 22' ' ' LEU . 77.5 m-85 53.67 53.21 11.8 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.357 -0.839 . . . . 0.0 109.95 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 96.89 -50.21 1.53 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 26.9 m -151.64 -44.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -1.071 . . . . 0.0 110.342 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 11' ' ' GLU . 0.4 OUTLIER 175.85 165.33 0.42 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.33 -0.856 . . . . 0.0 109.622 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.76 -23.65 22.35 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 O-C-N 123.571 1.301 . . . . 0.0 110.687 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.26 0.49 14.03 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.187 -0.945 . . . . 0.0 110.969 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.62 5.94 49.71 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.997 -1.064 . . . . 0.0 110.419 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -169.35 118.3 0.57 Allowed Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.126 -0.984 . . . . 0.0 110.118 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.407 HD22 ' CD1' ' A' ' 12' ' ' PHE . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.451 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.25 -35.53 79.23 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.4 -25.74 66.15 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.34 -0.85 . . . . 0.0 110.238 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -76.52 68.13 2.79 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.313 -0.867 . . . . 0.0 110.146 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.29 33.52 15.76 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.312 -0.867 . . . . 0.0 110.32 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -112.84 -36.0 1.6 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.2 tp -59.78 -32.54 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.315 -1.109 . . . . 0.0 110.175 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.86 118.06 22.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.399 -0.813 . . . . 0.0 110.133 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 8.2 t -144.6 132.05 20.88 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.415 -0.803 . . . . 0.0 110.227 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.1 t -155.37 33.46 0.37 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.345 -0.847 . . . . 0.0 110.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.3 30.35 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 m -100.59 67.37 1.29 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.388 -1.066 . . . . 0.0 110.119 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.87 75.84 7.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.0 110.228 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.9 -28.1 68.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 53.6 m -132.09 88.23 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.099 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -58.75 -32.17 69.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.253 -0.905 . . . . 0.0 110.313 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.482 HD13 HG21 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.482 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -82.44 -14.23 55.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 71' ' ' ILE . 12.4 tt0 -95.61 -30.75 13.62 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.255 -0.903 . . . . 0.0 110.178 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -59.19 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.318 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.08 -59.23 0.03 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -122.11 115.81 23.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -1.058 . . . . 0.0 110.006 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -121.98 27.78 7.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.0 110.237 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -95.96 18.8 56.77 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -174.79 152.87 1.63 Allowed Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.269 -1.136 . . . . 0.0 108.916 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.21 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.812 0 O-C-N 123.587 1.309 . . . . 0.0 110.845 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 51.3 70.96 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.048 -1.032 . . . . 0.0 110.66 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 70.2 mt -75.01 -35.95 61.95 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -74.69 -3.39 31.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.405 -0.809 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -106.79 -9.89 16.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.064 -1.022 . . . . 0.0 110.085 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' MET . . . . . 0.425 ' HB2' ' CB ' ' A' ' 91' ' ' GLU . 15.2 ptp -106.61 141.28 38.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 63.0 p -86.08 -173.61 4.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.582 -0.699 . . . . 0.0 111.117 -178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.583 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 4.9 pt-20 -62.02 -30.82 71.22 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.652 -0.655 . . . . 0.0 109.486 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.492 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 mt-10 -77.95 -42.41 33.04 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.425 ' CB ' ' HB2' ' A' ' 87' ' ' MET . 5.4 mm-40 -63.0 -43.92 97.45 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -67.27 -36.0 80.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.583 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 98' ' ' GLN . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.445 ' CD2' ' CD1' ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.78 -40.13 79.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.0 mtt -78.62 -18.58 54.3 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.51 -0.744 . . . . 0.0 109.941 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -81.1 -29.84 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.223 -0.923 . . . . 0.0 110.354 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 11.3 mmm -100.31 -14.94 18.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.314 -0.867 . . . . 0.0 110.614 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 65.3 p -98.74 -29.05 13.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.3 tp -99.84 27.62 5.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.281 -0.887 . . . . 0.0 110.233 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -132.03 26.69 4.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.809 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.97 47.93 0.87 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.81 68.07 8.03 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.4 -1.059 . . . . 0.0 110.194 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.27 78.19 0.5 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.324 -0.86 . . . . 0.0 110.208 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 106' ' ' PHE . 23.7 p90 -142.6 54.02 1.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.333 -0.854 . . . . 0.0 110.223 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.49 36.73 2.39 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.6 74.31 1.87 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.311 -1.111 . . . . 0.0 110.359 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.13 39.55 1.28 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.288 -0.883 . . . . 0.0 110.035 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.29 49.13 0.84 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.0 t -95.1 -35.97 11.69 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.356 -0.84 . . . . 0.0 110.14 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.235 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.508 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.445 ' CD1' ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.508 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.439 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.416 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.421 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' B' ' 43' ' ' LEU . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . 0.414 ' CD1' HD12 ' B' ' 67' ' ' LEU . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.439 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.43 ' CE1' HD23 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.459 HG22 HD11 ' B' ' 61' ' ' ILE . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.414 HD12 ' CD1' ' B' ' 45' ' ' PHE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.407 HG11 ' N ' ' B' ' 71' ' ' LEU . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.407 ' N ' HG11 ' B' ' 70' ' ' VAL . 7.8 mt -94.08 122.14 36.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -104.67 111.6 24.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.317 -0.865 . . . . 0.0 110.111 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 mt -93.36 175.46 6.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.371 -0.831 . . . . 0.0 110.275 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -108.21 36.63 2.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.63 149.37 19.86 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 CA-C-O 118.055 -1.414 . . . . 0.0 109.58 179.994 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.1 mtm -78.97 176.1 9.95 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.415 -0.803 . . . . 0.0 110.225 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.11 26.23 10.91 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 109.269 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.35 -110.94 3.27 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.5 mt 51.77 48.3 23.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.398 -1.06 . . . . 0.0 110.466 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -141.33 -153.56 5.98 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.46 49.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.331 -1.099 . . . . 0.0 110.245 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.0 m -116.73 -22.92 8.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.435 -0.791 . . . . 0.0 110.544 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -35.41 74.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -0.903 . . . . 0.0 110.31 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.488 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 13.5 p90 -148.05 59.49 1.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.301 -0.875 . . . . 0.0 110.37 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.3 75.32 0.24 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.456 -0.777 . . . . 0.0 110.247 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 51.9 62.63 2.6 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.361 -0.837 . . . . 0.0 110.59 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.98 28.17 0.73 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -116.71 -25.64 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -1.112 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.54 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -75.88 -179.82 1.24 Allowed Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 -179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.54 ' HD2' ' CB ' ' A' ' 15' ' ' ASP . 36.9 Cg_endo -60.86 78.37 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.278 0 O-C-N 123.69 1.363 . . . . 0.0 110.867 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 m 68.95 46.27 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 42.45 30.39 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.993 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -165.2 115.17 0.86 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.253 -0.905 . . . . 0.0 110.592 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.424 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.424 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.14 -28.4 69.62 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.19 -16.08 41.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.389 -0.82 . . . . 0.0 110.436 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -91.19 -57.11 2.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.181 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.58 25.93 4.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.822 . . . . 0.0 110.163 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -108.52 -45.12 1.08 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.3 tp -113.23 66.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -1.124 . . . . 0.0 110.237 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.1 -4.32 10.57 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.585 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 7.8 t -103.73 66.65 0.86 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.176 -0.952 . . . . 0.0 110.347 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.4 m -73.79 -56.24 5.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.322 -0.861 . . . . 0.0 110.176 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -160.55 52.81 0.35 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -87.38 54.01 3.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.352 -1.087 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -111.29 63.61 0.61 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.846 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.68 -37.3 42.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.304 -0.873 . . . . 0.0 110.191 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 p -96.7 69.45 2.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.297 -0.877 . . . . 0.0 110.251 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -69.77 0.42 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.333 -0.854 . . . . 0.0 110.107 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -80.09 -40.86 26.71 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.83 -36.13 75.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.39 -0.819 . . . . 0.0 109.997 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -73.13 -32.72 65.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.403 -0.811 . . . . 0.0 110.137 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.32 80.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -96.65 115.28 27.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -1.076 . . . . 0.0 110.058 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -122.5 3.32 9.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.295 -0.878 . . . . 0.0 110.609 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.47 -17.01 59.27 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -169.84 149.54 3.53 Favored Pre-proline 0 N--CA 1.487 1.411 0 O-C-N 121.217 -1.167 . . . . 0.0 108.85 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -76.09 40.38 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 123.516 1.271 . . . . 0.0 110.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.5 75.82 0.17 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.05 -1.031 . . . . 0.0 110.552 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -72.69 -33.07 66.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.281 -0.887 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.1 m -62.63 -23.34 67.02 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.276 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.8 t -80.5 -29.13 37.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.899 . . . . 0.0 110.033 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 33.7 mtm -87.67 119.42 27.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.361 -0.837 . . . . 0.0 109.826 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.7 p -79.62 -164.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.797 . . . . 0.0 110.51 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.546 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.7 pt-20 -66.29 -31.89 72.97 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.469 -0.769 . . . . 0.0 109.363 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.448 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.2 mt-10 -85.17 -40.39 16.77 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.73 -44.84 92.36 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.89 -34.19 76.17 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CD2' HD11 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.421 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . -67.93 -32.51 73.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 41.6 mtp -76.86 -21.55 54.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.69 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -83.49 -22.49 32.51 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.466 -0.771 . . . . 0.0 110.424 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 24.9 mmt -89.72 -26.94 20.39 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.341 -0.85 . . . . 0.0 110.412 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.29 -25.0 23.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.418 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 30.3 mt -82.6 3.23 29.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.341 -0.85 . . . . 0.0 110.639 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -141.43 50.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.13 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.14 -55.95 0.07 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.07 74.12 10.3 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -1.116 . . . . 0.0 110.196 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -153.09 28.48 0.51 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.39 -0.819 . . . . 0.0 110.184 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.06 75.11 1.63 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.362 -0.836 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -103.36 36.59 4.23 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -105.78 54.54 0.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.394 -1.062 . . . . 0.0 110.178 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.77 88.76 2.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.362 -0.836 . . . . 0.0 110.083 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -95.87 35.46 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.366 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.0 t -71.6 174.96 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.356 -0.84 . . . . 0.0 110.129 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.219 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.414 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.42 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.421 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.443 HD21 ' CD2' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . 0.435 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.443 ' CD2' HD21 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.411 HG22 HD12 ' B' ' 61' ' ' ILE . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.414 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.41 HG13 ' N ' ' B' ' 71' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.41 ' N ' HG13 ' B' ' 70' ' ' VAL . 9.4 mt -94.23 115.1 27.31 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.95 115.51 27.53 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.47 165.29 12.62 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.41 -0.806 . . . . 0.0 110.168 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -113.4 137.85 50.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.343 -0.848 . . . . 0.0 110.212 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.5 -90.83 1.03 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.42 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.945 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.162 0.506 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.525 ' O ' ' HB2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -155.16 -55.33 0.09 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.346 -0.846 . . . . 0.0 110.24 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 2' ' ' MET . 0.6 OUTLIER 76.83 35.97 0.36 Allowed 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.013 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.95 -105.46 0.04 OUTLIER Glycine 0 N--CA 1.481 1.639 0 N-CA-C 109.794 -1.323 . . . . 0.0 109.794 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.43 77.01 1.25 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.35 -1.088 . . . . 0.0 110.065 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -88.9 -103.57 1.02 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.28 -39.76 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.424 -1.045 . . . . 0.0 110.312 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 35.3 t -54.1 -28.83 41.82 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.271 -0.893 . . . . 0.0 110.285 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -35.76 80.7 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CD2' ' CG2' ' A' ' 14' ' ' VAL . 1.3 m-85 -112.81 94.57 4.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.345 -0.847 . . . . 0.0 110.03 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.605 ' O ' ' HB3' ' A' ' 12' ' ' PHE . 30.6 tt0 -140.45 127.62 20.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.428 -0.795 . . . . 0.0 109.694 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.605 ' HB3' ' O ' ' A' ' 11' ' ' GLU . 45.1 t80 66.55 -55.68 0.41 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.806 -0.559 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLU . . . -51.85 -26.04 17.26 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.471 ' CG2' ' CD2' ' A' ' 10' ' ' PHE . 84.2 t -94.78 -66.17 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.193 -1.181 . . . . 0.0 110.097 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.43 168.47 9.08 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.52 -19.24 28.63 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.713 1.375 . . . . 0.0 110.718 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.62 -10.31 57.71 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 0.0 110.621 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.33 -15.43 63.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.194 -0.941 . . . . 0.0 110.534 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.49 120.47 0.6 Allowed Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.24 -0.912 . . . . 0.0 109.852 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.02 -34.17 59.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.35 -18.73 59.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.377 -0.827 . . . . 0.0 110.25 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -107.95 -38.12 5.9 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.38 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.7 -18.4 12.77 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.418 -0.801 . . . . 0.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.81 -81.86 0.22 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.1 pt -93.85 68.33 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -1.125 . . . . 0.0 110.283 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.05 -32.12 15.3 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.426 -0.796 . . . . 0.0 110.159 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.1 p -87.03 120.03 27.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.322 -0.861 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.9 m -128.7 163.52 24.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 110.217 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.51 98.3 0.21 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -83.09 72.53 10.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.357 -1.084 . . . . 0.0 110.285 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -112.79 94.56 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.41 -0.806 . . . . 0.0 110.073 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -115.54 -36.75 4.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.463 -0.773 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 68.1 m -118.61 71.41 0.84 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.37 -0.831 . . . . 0.0 110.257 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -77.62 -60.36 2.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.293 -0.879 . . . . 0.0 110.265 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.498 ' CD1' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.498 ' N ' ' CD1' ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -86.62 -14.07 43.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' O ' ' A' ' 71' ' ' ILE . 38.0 tt0 -90.59 -41.51 11.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.173 -0.955 . . . . 0.0 110.139 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.04 -25.13 16.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.448 -0.783 . . . . 0.0 110.246 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -29.06 71.55 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.55 100.5 3.79 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.282 -1.128 . . . . 0.0 110.254 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 91.7 m -92.87 -104.38 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.503 -0.748 . . . . 0.0 109.873 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 51.16 39.71 42.74 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' A' ' 83' ' ' ASP . 0.3 OUTLIER -157.99 140.41 10.43 Favored Pre-proline 0 C--N 1.305 -1.327 0 O-C-N 121.391 -1.064 . . . . 0.0 108.667 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -74.51 40.02 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 123.44 1.232 . . . . 0.0 110.678 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 81' ' ' LEU . 52.3 m-20 49.76 83.2 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 110.497 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -82.78 -38.99 22.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.45 -0.781 . . . . 0.0 110.339 -179.741 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.11 -12.01 60.12 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.407 -0.808 . . . . 0.0 110.691 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.3 -25.12 14.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 109.847 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 20.2 mtt -67.52 -162.32 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.46 -0.775 . . . . 0.0 109.822 179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.4 p -148.55 -171.1 3.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.278 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -65.78 -32.91 74.72 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.47 -0.769 . . . . 0.0 109.246 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.435 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 4.3 mt-10 -85.26 -42.13 14.93 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.361 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -44.93 94.67 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -67.27 -33.62 75.68 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.492 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . -77.07 -32.99 57.15 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.419 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 9.4 mtt -83.07 -23.55 33.1 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.404 -0.81 . . . . 0.0 109.944 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -83.12 -35.88 25.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.38 -0.825 . . . . 0.0 110.34 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.1 -26.31 42.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.364 -0.835 . . . . 0.0 110.196 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.412 ' HB3' ' N ' ' B' ' 46' ' ' ALA . 62.4 m -80.97 -36.4 30.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.379 -0.826 . . . . 0.0 110.501 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.69 -14.7 59.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.308 -0.87 . . . . 0.0 110.495 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.11 35.77 1.69 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.915 . . . . 0.0 110.236 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.16 86.3 0.25 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.83 83.79 0.45 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.361 -1.082 . . . . 0.0 110.258 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -96.19 49.6 1.14 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.084 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -115.36 -43.5 3.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.456 -0.777 . . . . 0.0 110.135 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.53 77.15 0.39 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.52 86.63 2.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -1.102 . . . . 0.0 110.14 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.28 84.5 0.23 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.402 -0.811 . . . . 0.0 110.251 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 54.32 31.78 15.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.363 -0.836 . . . . 0.0 110.476 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.9 m -112.63 99.67 8.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.311 -0.868 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.2 -179.922 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.477 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.419 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.477 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.456 HG13 ' HB3' ' B' ' 50' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.451 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.451 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.492 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . 0.412 ' N ' ' HB3' ' A' ' 100' ' ' SER . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.419 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.456 ' HB3' HG13 ' B' ' 23' ' ' ILE . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.441 ' CG ' ' CD2' ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.403 ' N ' HG12 ' B' ' 70' ' ' VAL . 0.7 OUTLIER -94.26 116.62 29.03 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -107.08 130.57 54.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.448 -0.782 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 10.9 mt -71.13 179.22 2.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.336 -0.852 . . . . 0.0 110.24 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.61 158.77 35.6 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.361 -0.837 . . . . 0.0 110.194 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.75 61.18 0.16 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.579 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.261 0.553 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -166.6 2.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.072 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.83 24.5 12.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.445 -0.784 . . . . 0.0 109.569 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.17 68.89 3.26 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.92 -64.91 0.34 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.335 -1.097 . . . . 0.0 110.158 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.78 172.3 31.85 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.34 28.36 4.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -1.093 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.3 t -140.1 21.05 2.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.34 -0.85 . . . . 0.0 110.417 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 45.5 p-10 -91.42 -14.69 30.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.884 . . . . 0.0 110.379 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.406 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 19.8 m-85 -127.68 56.78 1.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.223 -0.923 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 57.53 4.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.278 -0.889 . . . . 0.0 110.398 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.426 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 6.7 m-85 51.28 40.55 26.5 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.347 -0.846 . . . . 0.0 110.531 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.44 27.6 2.96 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 35.8 m -148.68 -40.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -1.105 . . . . 0.0 110.469 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.0 p30 -135.86 163.52 49.87 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.467 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 35.6 Cg_endo -57.99 73.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.836 1.44 . . . . 0.0 111.745 -178.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.519 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.7 m 63.26 34.17 13.55 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.51 0.671 . . . . 0.0 109.361 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 37.21 35.29 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.221 0.534 . . . . 0.0 111.226 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.62 120.88 0.6 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.42 -0.8 . . . . 0.0 109.801 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.419 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -28.58 61.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.2 -10.28 59.31 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.398 -0.814 . . . . 0.0 110.514 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -100.96 -36.15 9.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.155 -0.966 . . . . 0.0 110.254 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.54 -32.43 11.11 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.206 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.24 -58.73 3.84 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 39.9 mm -83.87 68.74 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -1.095 . . . . 0.0 110.214 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -168.96 33.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.262 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.0 p -139.89 81.76 1.84 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.319 -0.863 . . . . 0.0 110.245 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 p -100.38 71.52 1.56 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.411 -0.805 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.17 31.13 0.31 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 m -129.63 101.11 5.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -1.105 . . . . 0.0 110.136 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -82.33 73.48 9.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.365 -0.834 . . . . 0.0 110.147 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.0 -58.62 5.1 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.397 -0.815 . . . . 0.0 110.285 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.5 m -133.04 96.66 3.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.318 -0.864 . . . . 0.0 110.295 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.89 -33.57 75.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.292 -0.88 . . . . 0.0 110.105 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -76.1 -39.9 54.2 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.07 -57.44 4.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.448 -0.783 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.429 ' CD1' ' OG1' ' A' ' 79' ' ' THR . 0.1 OUTLIER 50.98 76.39 0.16 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.372 -0.83 . . . . 0.0 110.344 -179.958 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.05 -79.35 0.09 OUTLIER Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.7 107.99 6.27 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -1.122 . . . . 0.0 110.267 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.429 ' OG1' ' CD1' ' A' ' 76' ' ' PHE . 1.3 m -153.29 25.33 0.53 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.358 -0.839 . . . . 0.0 110.218 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -97.41 21.93 43.5 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.98 144.68 11.02 Favored Pre-proline 0 N--CA 1.484 1.243 0 O-C-N 121.34 -1.094 . . . . 0.0 108.733 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.39 39.45 0.68 Allowed 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 123.495 1.26 . . . . 0.0 110.697 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 50.76 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 tp -60.93 -32.23 71.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 110.163 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 81.4 p -60.82 -23.75 65.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.359 -0.838 . . . . 0.0 110.298 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -80.99 -27.76 35.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.348 -0.845 . . . . 0.0 109.897 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.6 mtt -88.15 119.82 28.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.876 . . . . 0.0 109.935 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 67.6 p -78.38 -164.52 0.57 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 110.424 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.487 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.6 pt-20 -67.3 -31.26 71.44 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 0.0 109.259 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.471 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.9 mt-10 -85.42 -40.26 16.64 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -45.18 92.0 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.05 -33.86 76.43 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.487 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.428 ' CD2' HD11 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.423 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . . . -82.4 -32.63 29.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -26.3 46.39 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.261 -0.899 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -80.15 -44.13 20.41 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.524 -0.735 . . . . 0.0 110.202 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 30.8 mtm -78.58 -10.24 59.66 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.441 -0.787 . . . . 0.0 110.566 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -97.78 -21.21 17.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.236 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 15.1 tp -91.51 16.45 10.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.401 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.88 -37.38 10.73 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.204 -0.935 . . . . 0.0 110.155 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -70.56 -34.33 67.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -99.57 88.57 3.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -1.097 . . . . 0.0 110.147 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -71.83 65.31 0.51 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -168.44 107.32 0.49 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -146.25 131.19 3.97 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -127.42 76.24 1.65 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.318 -1.107 . . . . 0.0 110.188 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.76 38.59 4.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.311 -0.868 . . . . 0.0 110.307 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 51.78 55.2 9.68 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.28 -0.888 . . . . 0.0 110.483 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -99.67 175.09 5.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.212 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.243 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.451 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.428 HD11 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.411 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.451 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.458 HG13 ' HB3' ' B' ' 50' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 30' ' ' ILE . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.492 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.492 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.423 ' HB ' ' HB2' ' A' ' 96' ' ' ALA . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.458 ' HB3' HG13 ' B' ' 23' ' ' ILE . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.445 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.429 ' CE2' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.434 HD12 HG23 ' B' ' 61' ' ' ILE . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.414 HG11 ' N ' ' B' ' 71' ' ' LEU . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . 0.414 ' N ' HG11 ' B' ' 70' ' ' VAL . 4.7 mt -93.93 126.4 39.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.03 102.08 11.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.353 -0.842 . . . . 0.0 110.045 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.14 171.33 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.302 -0.874 . . . . 0.0 110.187 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -119.73 170.83 8.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.385 -0.822 . . . . 0.0 110.329 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 158.98 79.47 0.03 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.547 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 m170 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.22 0.534 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.57 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -155.53 -52.21 0.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.111 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.57 ' CB ' ' O ' ' A' ' 2' ' ' MET . 3.8 tp 80.97 35.87 0.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.15 -85.82 0.37 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 52.46 34.65 15.75 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.368 -1.077 . . . . 0.0 110.444 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -93.22 112.49 4.29 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.46 29.6 3.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.357 -1.084 . . . . 0.0 110.24 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -116.39 -30.35 5.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.344 -0.847 . . . . 0.0 110.287 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.08 -38.37 76.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.284 -0.885 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.09 87.0 2.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.373 -0.829 . . . . 0.0 110.149 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -98.15 75.73 2.32 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -159.96 -44.34 0.05 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.175 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -113.07 30.37 7.42 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.7 m -130.97 -39.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.445 -1.032 . . . . 0.0 110.295 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.0 p-10 -125.08 142.93 42.66 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.414 -0.804 . . . . 0.0 110.241 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 -28.56 17.91 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.566 1.298 . . . . 0.0 110.377 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -61.1 -23.39 65.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.72 -21.64 55.59 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.187 -0.946 . . . . 0.0 110.418 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.53 120.31 0.6 Allowed Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.451 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.05 -32.96 39.39 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.3 -12.7 56.38 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.31 -0.869 . . . . 0.0 110.535 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.55 -50.24 10.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.275 -0.891 . . . . 0.0 110.26 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.63 32.01 6.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.307 -0.871 . . . . 0.0 110.3 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -116.39 -34.26 1.34 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.2 tt -97.6 -19.42 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.393 -1.063 . . . . 0.0 110.413 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.38 118.62 10.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.223 -0.923 . . . . 0.0 110.272 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.8 t -63.01 155.61 27.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.374 -0.829 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.7 m -98.15 128.43 44.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.3 -0.875 . . . . 0.0 110.169 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -138.91 -98.37 0.42 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.4 t -160.7 66.41 0.32 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.393 -1.063 . . . . 0.0 110.204 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' O ' ' N ' ' A' ' 62' ' ' SER . 7.1 mt-10 -143.79 43.43 1.47 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.444 -0.785 . . . . 0.0 110.46 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.648 ' O ' ' N ' ' A' ' 63' ' ' ASP . 23.2 m-20 -55.67 97.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 60' ' ' GLU . 0.6 OUTLIER -51.09 76.81 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.598 0.713 . . . . 0.0 110.807 -177.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.648 ' N ' ' O ' ' A' ' 61' ' ' ASP . 31.6 m-20 -73.66 -44.94 55.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.696 -0.627 . . . . 0.0 110.085 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.41 ' O ' ' CB ' ' A' ' 75' ' ' GLU . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.62 -51.08 5.71 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.6 tm-20 -71.15 -10.23 59.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.351 -0.843 . . . . 0.0 110.559 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.74 99.57 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.201 -0.937 . . . . 0.0 110.542 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.63 -59.73 0.51 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -85.06 115.77 23.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -1.068 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.0 m -144.95 44.37 1.35 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.443 -0.786 . . . . 0.0 110.221 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.97 25.54 27.9 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.57 148.79 2.32 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.268 -1.137 . . . . 0.0 108.942 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.34 38.67 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 O-C-N 123.52 1.274 . . . . 0.0 110.737 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.79 92.5 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.114 -0.991 . . . . 0.0 110.476 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 41.2 mt -52.89 -30.24 32.99 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.323 -0.861 . . . . 0.0 110.472 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.21 -18.87 65.62 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.0 p -84.83 -28.38 26.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 110.142 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 30.4 mtt -76.29 118.16 18.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.35 -0.844 . . . . 0.0 110.088 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 79.4 p -79.87 -163.32 0.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.381 -0.825 . . . . 0.0 110.607 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.499 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 15.0 pt-20 -67.09 -32.11 73.05 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.526 -0.734 . . . . 0.0 109.303 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.457 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.6 mt-10 -85.17 -39.75 17.49 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -63.9 -46.05 86.58 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.401 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 -65.96 -34.8 78.94 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 177.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.499 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.447 ' CD2' ' CD1' ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.492 ' HB1' HG12 ' B' ' 44' ' ' ILE . . . -78.77 -35.55 44.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.9 mtt -80.37 -22.79 40.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.404 -0.81 . . . . 0.0 109.917 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -80.96 -43.63 19.42 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.262 -0.899 . . . . 0.0 110.518 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -17.87 56.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.385 -0.822 . . . . 0.0 110.603 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.0 m -90.29 -23.79 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.95 . . . . 0.0 110.318 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.4 tp -87.71 10.87 16.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.221 -0.925 . . . . 0.0 110.475 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -94.44 -61.95 1.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.236 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 111.77 88.42 1.8 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -118.37 93.08 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.328 -1.101 . . . . 0.0 110.242 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.51 53.44 0.74 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.789 . . . . 0.0 110.141 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -117.71 -48.89 2.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.94 -121.54 7.28 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.13 87.1 4.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -1.121 . . . . 0.0 110.183 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.58 80.66 4.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.292 -0.88 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 52.29 55.54 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.36 -0.838 . . . . 0.0 110.446 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.23 -47.44 13.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.309 -0.87 . . . . 0.0 110.255 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.251 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HG2' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.447 ' CD1' ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.436 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.456 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.418 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' CG2' ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.492 HG12 ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.437 HD23 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.456 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.437 ' CG ' HD23 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 96' ' ' ALA . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt -94.15 125.34 38.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 12.0 ttt180 -101.55 107.12 18.31 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -0.863 . . . . 0.0 110.275 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 mt -99.19 145.74 26.89 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.375 -0.828 . . . . 0.0 110.09 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -166.32 123.58 1.36 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.312 -0.867 . . . . 0.0 110.218 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.54 91.32 0.29 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 CA-C-O 117.977 -1.457 . . . . 0.0 109.558 179.943 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.312 0.577 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttm -74.52 -164.42 0.27 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.287 -0.883 . . . . 0.0 110.173 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mp -111.66 24.38 12.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.482 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.59 -121.32 0.67 Allowed Glycine 0 N--CA 1.487 2.073 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tp 52.53 34.54 15.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.302 -1.117 . . . . 0.0 110.418 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.78 163.81 20.56 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.02 -34.8 4.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -1.092 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -60.23 -30.13 69.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.66 -27.15 68.47 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 110.19 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.41 ' CD2' HG23 ' A' ' 14' ' ' VAL . 28.3 t80 -111.08 -20.52 12.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.429 -0.795 . . . . 0.0 110.252 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -95.29 51.58 1.34 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 0.0 110.378 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -168.76 -52.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.21 -24.06 49.29 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.41 HG23 ' CD2' ' A' ' 10' ' ' PHE . 59.6 t -76.43 -67.24 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.274 -1.133 . . . . 0.0 110.32 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 17' ' ' SER . 30.0 p30 -116.87 161.75 30.79 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.275 -0.891 . . . . 0.0 110.063 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.425 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 36.2 Cg_endo -58.46 73.22 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.863 1.454 . . . . 0.0 111.767 -178.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.51 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 63.75 34.78 11.78 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.659 0.743 . . . . 0.0 109.277 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 38.22 33.3 0.06 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.354 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.65 117.37 0.54 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.876 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.435 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.435 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.87 69.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -89.2 -19.83 24.94 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.376 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -103.8 28.22 6.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.852 . . . . 0.0 110.177 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.9 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.146 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.97 -53.32 15.36 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.9 tp -111.69 -17.6 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.339 -1.095 . . . . 0.0 110.419 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.88 -164.02 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.128 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 t -112.15 154.49 25.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.837 . . . . 0.0 110.206 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.5 m -79.58 93.14 5.41 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.412 -0.805 . . . . 0.0 110.29 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -151.2 -143.83 3.79 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.0 p -153.51 97.61 2.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -1.113 . . . . 0.0 110.259 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -106.1 45.25 0.98 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.855 . . . . 0.0 110.218 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -130.51 -41.45 1.21 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.443 -0.786 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -118.13 79.54 1.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.375 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -56.19 -29.54 61.02 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.872 . . . . 0.0 110.212 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.409 ' O ' ' CB ' ' A' ' 75' ' ' GLU . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -110.51 -17.08 13.52 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 26.4 tt0 -107.26 -15.61 14.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.096 -1.003 . . . . 0.0 110.969 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CG ' ' O ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -84.18 43.07 0.92 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.082 -1.012 . . . . 0.0 111.094 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -84.32 0.1 OUTLIER Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.649 -1.381 . . . . 0.0 109.649 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -71.8 -35.48 69.98 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.419 -1.048 . . . . 0.0 110.308 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.422 ' O ' ' CG2' ' A' ' 79' ' ' THR . 88.9 m 52.56 25.15 3.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.393 -0.817 . . . . 0.0 110.158 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.434 ' C ' ' HG ' ' A' ' 81' ' ' LEU . . . 94.72 -89.0 1.18 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.434 ' HG ' ' C ' ' A' ' 80' ' ' GLY . 94.5 mt -152.26 146.26 18.29 Favored Pre-proline 0 C--N 1.305 -1.348 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -77.54 36.98 0.58 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 123.368 1.194 . . . . 0.0 110.807 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.43 62.16 2.83 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.218 -0.926 . . . . 0.0 110.62 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mt -60.88 -36.38 79.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.34 -0.85 . . . . 0.0 110.184 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.6 p -74.44 -3.6 31.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.402 -0.811 . . . . 0.0 110.633 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.34 11.95 14.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.164 -0.96 . . . . 0.0 110.13 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.3 mtm -94.76 -163.83 1.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.918 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 61.3 p -136.54 179.41 6.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 110.318 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.598 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -62.58 -30.88 71.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.488 -0.758 . . . . 0.0 109.473 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.46 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 30.1 mt-10 -84.17 -42.68 15.74 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.335 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.02 -40.66 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -70.69 -36.37 73.25 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.598 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.416 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.04 -27.93 48.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.93 -24.3 38.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.592 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.34 -21.6 28.84 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.45 -0.781 . . . . 0.0 110.314 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.5 ttm -97.07 -14.78 21.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.237 -0.914 . . . . 0.0 110.662 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.9 t -100.65 -39.94 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.168 -0.957 . . . . 0.0 110.379 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.56 -31.37 69.37 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.379 -0.826 . . . . 0.0 109.961 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.83 75.44 1.45 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.339 -0.851 . . . . 0.0 110.304 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.35 84.13 0.35 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.59 81.04 5.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.387 -1.066 . . . . 0.0 110.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -140.99 32.79 1.76 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.34 -0.85 . . . . 0.0 110.215 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.31 39.27 2.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.38 -0.825 . . . . 0.0 110.2 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -122.27 76.49 0.35 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.16 60.96 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.198 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.44 74.13 4.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -151.78 107.84 3.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.385 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 14.7 p -110.5 -40.0 4.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.374 -0.829 . . . . 0.0 110.124 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.165 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.419 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.419 HD11 HG21 ' B' ' 23' ' ' ILE . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . 0.407 ' CG2' ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.411 ' HG2' ' HG3' ' B' ' 40' ' ' GLN . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.411 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.462 ' HA ' ' CZ ' ' B' ' 59' ' ' TYR . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.462 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . 0.469 HD12 HG22 ' B' ' 61' ' ' ILE . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.416 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.413 HG22 HG13 ' B' ' 44' ' ' ILE . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -93.88 103.8 15.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -84.42 94.3 8.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.322 -0.861 . . . . 0.0 110.156 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.67 144.85 44.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -0.874 . . . . 0.0 110.289 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -71.1 96.64 1.37 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.38 -0.825 . . . . 0.0 110.118 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.29 156.0 15.94 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 118.046 -1.419 . . . . 0.0 109.632 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.207 0.527 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.0 ttp -160.86 -172.6 3.55 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -0.84 . . . . 0.0 110.16 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -112.77 25.63 11.26 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.42 -0.8 . . . . 0.0 109.572 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.93 70.78 2.96 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.29 95.47 4.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.365 -1.08 . . . . 0.0 110.252 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.1 -98.8 0.97 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.07 46.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.301 -1.117 . . . . 0.0 110.223 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -150.11 24.99 0.82 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.356 -0.84 . . . . 0.0 110.363 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -112.22 -10.49 13.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 110.502 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' O ' ' CD2' ' A' ' 10' ' ' PHE . 46.4 p90 -131.65 36.12 3.76 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.179 -0.95 . . . . 0.0 110.355 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.93 37.47 3.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.392 -0.818 . . . . 0.0 110.123 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 13' ' ' GLY . 51.8 p90 -170.52 -37.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.434 ' N ' ' CD2' ' A' ' 12' ' ' PHE . . . -107.95 38.43 3.33 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.437 HG21 ' N ' ' A' ' 15' ' ' ASP . 31.9 m -128.97 -40.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.237 -1.155 . . . . 0.0 110.275 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.437 ' N ' HG21 ' A' ' 14' ' ' VAL . 0.7 OUTLIER -167.25 149.35 5.5 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.274 -0.891 . . . . 0.0 110.078 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.7 -14.71 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 123.794 1.418 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.7 p -74.73 -4.27 36.46 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.245 -0.909 . . . . 0.0 110.713 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.39 6.0 40.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.164 -0.96 . . . . 0.0 110.473 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -163.96 114.89 0.98 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.198 -0.939 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.412 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.441 ' O ' ' CB ' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.441 ' CB ' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.29 -21.66 66.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 23.48 6.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.345 -0.847 . . . . 0.0 110.363 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -126.62 -45.32 1.63 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.824 . . . . 0.0 110.095 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.04 -33.68 9.62 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.468 -0.77 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.25 -35.53 70.08 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . 0.403 ' CG2' ' O ' ' A' ' 54' ' ' ILE . 6.8 tp -69.5 82.13 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.474 -1.015 . . . . 0.0 110.013 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -49.4 148.24 2.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.602 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -61.81 139.38 58.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.475 -0.765 . . . . 0.0 110.395 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.48 -165.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.395 -0.816 . . . . 0.0 109.976 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.93 30.29 5.1 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 9.7 t -95.38 64.86 2.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -1.054 . . . . 0.0 110.255 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -117.61 91.72 3.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.387 -0.821 . . . . 0.0 110.202 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.79 -43.21 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.341 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.1 70.72 0.98 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -77.02 -56.12 4.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.281 -0.887 . . . . 0.0 110.105 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -85.82 -37.41 19.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -80.95 -43.73 19.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.372 -0.83 . . . . 0.0 110.332 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.39 109.93 12.99 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.325 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -127.73 78.99 0.38 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.98 99.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -151.3 77.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -0.859 . . . . 0.0 110.209 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.83 41.01 1.73 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.52 148.84 1.55 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.312 -1.111 . . . . 0.0 108.937 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.57 63.7 2.96 Favored 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 123.638 1.336 . . . . 0.0 110.24 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.38 122.26 13.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.415 -0.803 . . . . 0.0 110.17 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.8 -37.66 29.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.208 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.3 p -61.49 -20.99 63.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.421 -0.799 . . . . 0.0 110.422 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.0 t -86.45 -31.04 21.59 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.077 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 10.0 mtm -76.59 121.33 23.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 109.996 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -79.74 -165.02 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.35 -0.844 . . . . 0.0 110.589 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.519 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -66.02 -31.71 72.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.5 -0.75 . . . . 0.0 109.301 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . 0.469 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 9.2 mt-10 -85.35 -40.56 16.38 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.83 -44.91 91.81 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.6 mt-30 -67.17 -33.53 75.59 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.519 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.447 ' CD2' HD12 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.485 ' HB2' HG12 ' B' ' 44' ' ' ILE . . . -78.76 -35.01 45.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.452 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 2.0 mtt -79.18 -26.65 42.65 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.218 -0.926 . . . . 0.0 109.597 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.8 tp60 -87.65 -23.0 24.38 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.539 -0.725 . . . . 0.0 110.284 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.3 tpp -96.09 -19.83 19.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.289 -0.882 . . . . 0.0 110.617 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 m -95.52 -32.79 12.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.181 -0.949 . . . . 0.0 110.519 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.57 -27.64 66.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.316 -0.865 . . . . 0.0 109.954 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -74.79 -37.68 62.33 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.293 -0.88 . . . . 0.0 110.356 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.09 112.74 0.27 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.22 81.33 1.42 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.372 -1.076 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.03 -55.82 3.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.416 -0.803 . . . . 0.0 110.083 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -110.53 49.09 0.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 110.05 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 91.76 0.07 OUTLIER Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.22 66.24 0.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.437 -1.037 . . . . 0.0 110.107 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.2 67.57 0.95 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.285 -0.884 . . . . 0.0 110.34 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -114.81 -52.35 2.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.9 p -148.69 130.29 14.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.198 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.249 179.95 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LEU . . . . . 0.448 ' CD2' ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.478 HD13 HG22 ' B' ' 13' ' ' ILE . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' B' ' 50' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.528 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' GLN . . . . . 0.528 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . 0.485 HG12 ' HB2' ' A' ' 96' ' ' ALA . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' GLY . . . . . 0.452 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' B' ' 23' ' ' ILE . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.447 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' THR . . . . . 0.539 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' TYR . . . . . 0.46 ' CZ ' ' HA ' ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.44 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . 0.44 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' VAL . . . . . 0.42 ' CG2' ' HB3' ' A' ' 96' ' ' ALA . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.94 124.84 38.21 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.01 73.13 2.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.42 -0.8 . . . . 0.0 110.157 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.11 110.07 22.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.355 -0.841 . . . . 0.0 110.274 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -75.09 178.44 5.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.403 -0.811 . . . . 0.0 110.141 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.69 -130.42 2.44 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.901 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.775 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.276 0.56 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.484 ' HB3' HG13 ' B' ' 70' ' ' VAL . 37.4 mt-30 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.486 HG12 HD11 ' B' ' 44' ' ' ILE . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.642 ' CD2' HD23 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.529 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.784 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.642 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.74 HD23 ' HE3' ' B' ' 33' ' ' LYS . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.784 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.405 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.578 HG23 HD12 ' B' ' 43' ' ' LEU . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.621 HG12 HD11 ' B' ' 15' ' ' LEU . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.74 ' HE3' HD23 ' B' ' 15' ' ' LEU . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.525 HG23 ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.73 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.486 HD11 HG12 ' A' ' 93' ' ' ILE . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.497 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.423 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' B' ' 56' ' ' LEU . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' B' ' 45' ' ' PHE . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.529 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.512 HG22 ' HB2' ' A' ' 96' ' ' ALA . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.323 0.582 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.402 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.646 ' HB3' HG13 ' B' ' 70' ' ' VAL . 60.4 mt-30 . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.623 ' CD2' HD23 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.597 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.803 HD13 HG21 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' B' ' 12' ' ' THR . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.576 HG23 ' CE1' ' B' ' 4' ' ' PHE . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.803 HG21 HD13 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.748 HG23 HD12 ' B' ' 43' ' ' LEU . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.616 ' HE3' HG22 ' B' ' 23' ' ' ILE . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' B' ' 17' ' ' VAL . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.52 HG23 ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.52 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.748 HD12 HG23 ' B' ' 23' ' ' ILE . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.597 HG21 ' C ' ' A' ' 96' ' ' ALA . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.626 HD22 ' CG ' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.507 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.626 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.446 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 92' ' ' GLN . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 71' ' ' LEU . 10.1 mt . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.797 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 24' ' ' LEU . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.552 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.628 ' HB3' HG13 ' B' ' 70' ' ' VAL . 79.6 mt-30 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.545 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.83 ' CD2' HD23 ' B' ' 8' ' ' LEU . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.726 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.83 HD23 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.715 ' C ' HD12 ' B' ' 15' ' ' LEU . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.715 HD12 ' C ' ' B' ' 14' ' ' THR . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.405 HG12 ' CD ' ' B' ' 29' ' ' LYS . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.452 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.582 HG23 HD12 ' B' ' 43' ' ' LEU . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.523 ' HE2' HG22 ' B' ' 23' ' ' ILE . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.405 ' CD ' HG12 ' B' ' 17' ' ' VAL . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.4 ' CE ' ' HG ' ' B' ' 15' ' ' LEU . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.541 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.545 ' NE ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.787 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.787 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.458 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' B' ' 61' ' ' ILE . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.734 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.569 HD12 ' HA ' ' B' ' 56' ' ' LEU . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.41 HD21 HD13 ' B' ' 61' ' ' ILE . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.628 HG13 ' HB3' ' A' ' 92' ' ' GLN . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 71' ' ' LEU . 12.7 mt . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 24' ' ' LEU . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.541 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.282 0.563 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.609 ' HB3' HG13 ' B' ' 70' ' ' VAL . 39.5 mt-30 . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.789 ' CD2' HD23 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.625 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.694 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.705 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.789 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.705 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.694 HG23 ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.476 ' O ' HD12 ' B' ' 56' ' ' LEU . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.595 HG23 HD12 ' B' ' 43' ' ' LEU . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.416 ' CD ' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.503 HG23 ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.409 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.437 ' HB2' ' HB ' ' B' ' 70' ' ' VAL . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.802 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.643 ' HB2' HD23 ' B' ' 67' ' ' LEU . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.523 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.598 ' CD2' HD22 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.581 HD12 ' HA ' ' B' ' 56' ' ' LEU . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.643 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.665 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.665 ' N ' HD23 ' B' ' 69' ' ' LEU . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.833 0.349 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.645 ' O ' HG23 ' A' ' 28' ' ' VAL . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 24' ' ' LEU . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.175 0.512 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.479 ' HB3' HG13 ' B' ' 70' ' ' VAL . 32.8 mt-30 . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 94' ' ' ALA . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.422 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.747 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.564 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.449 HD13 HG21 ' B' ' 17' ' ' VAL . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.456 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.567 HG22 HD23 ' B' ' 69' ' ' LEU . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.774 ' C ' HD12 ' B' ' 15' ' ' LEU . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.774 HD12 ' C ' ' B' ' 14' ' ' THR . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.564 HG23 ' SD ' ' B' ' 1' ' ' MET . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.423 ' O ' HD22 ' B' ' 56' ' ' LEU . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.445 ' O ' HD13 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.79 HG21 HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.535 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.535 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.841 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 96' ' ' ALA . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.644 ' HB3' HD21 ' B' ' 50' ' ' LEU . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.841 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.805 ' HA ' HD12 ' B' ' 61' ' ' ILE . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.524 ' CG ' HD22 ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.532 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.567 HD23 HG22 ' B' ' 7' ' ' THR . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.812 0.339 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.456 HD12 ' N ' ' A' ' 22' ' ' LEU . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.736 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 24' ' ' LEU . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.222 0.534 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.61 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.428 HD11 ' HD2' ' B' ' 42' ' ' ARG . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.785 ' CD2' HD23 ' B' ' 8' ' ' LEU . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.807 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.475 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.518 HD13 HG21 ' B' ' 17' ' ' VAL . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.529 HG22 HD23 ' B' ' 69' ' ' LEU . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.785 HD23 ' CD2' ' A' ' 95' ' ' TYR . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.529 ' O ' HD12 ' B' ' 15' ' ' LEU . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.562 HD23 ' HB3' ' B' ' 29' ' ' LYS . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.518 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.431 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.562 ' HB3' HD23 ' B' ' 15' ' ' LEU . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.546 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HD2' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.807 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.629 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' B' ' 43' ' ' LEU . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.475 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.431 HD12 ' O ' ' B' ' 18' ' ' GLU . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.579 ' CG ' HD22 ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.629 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.529 HD23 HG22 ' B' ' 7' ' ' THR . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.61 HG13 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.0 t0 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 70' ' ' THR . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 66' ' ' LEU . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.5 mt-30 . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 17' ' ' VAL . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.598 HG22 HD23 ' B' ' 69' ' ' LEU . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.487 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.561 HD11 HG12 ' B' ' 30' ' ' ILE . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.401 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.459 ' O ' HD12 ' B' ' 56' ' ' LEU . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.847 HG23 HD12 ' B' ' 43' ' ' LEU . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.422 HG21 HD21 ' B' ' 56' ' ' LEU . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.561 HG12 HD11 ' B' ' 15' ' ' LEU . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HG3' HD22 ' B' ' 15' ' ' LEU . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.466 HG23 ' HD2' ' B' ' 37' ' ' PRO . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.466 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.426 ' CG ' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.488 ' O ' HD12 ' B' ' 69' ' ' LEU . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 23' ' ' ILE . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.435 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.482 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.848 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.454 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.459 HD12 ' O ' ' B' ' 18' ' ' GLU . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.848 ' CG ' HD22 ' B' ' 50' ' ' LEU . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.431 HD13 HD21 ' B' ' 67' ' ' LEU . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HG22 ' B' ' 7' ' ' THR . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.57 HG13 ' HB3' ' A' ' 92' ' ' GLN . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 22' ' ' LEU . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.74 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.514 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.321 0.581 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' B' ' 70' ' ' VAL . 36.7 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.72 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB2' ' CG2' ' B' ' 70' ' ' VAL . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 12' ' ' THR . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.72 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 6' ' ' LYS . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.401 HD11 HG12 ' B' ' 30' ' ' ILE . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.455 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.526 HD13 HD13 ' B' ' 69' ' ' LEU . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.484 HG23 ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 24.3 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.426 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.459 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 61' ' ' ILE . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.533 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' B' ' 56' ' ' LEU . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.426 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.526 HD13 HD13 ' B' ' 30' ' ' ILE . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 92' ' ' GLN . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.703 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 24' ' ' LEU . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.413 ' OE2' HG12 ' A' ' 28' ' ' VAL . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ARG . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.266 0.555 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 71' ' ' ILE . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.48 ' N ' HG23 ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.721 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.7 mt-30 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.77 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.459 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' B' ' 12' ' ' THR . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.455 ' HA ' ' CE2' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.562 HD11 HG12 ' B' ' 30' ' ' ILE . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.573 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' B' ' 50' ' ' LEU . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CD ' HG12 ' B' ' 17' ' ' VAL . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.562 HG12 HD11 ' B' ' 15' ' ' LEU . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.489 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.908 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.77 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.908 HD12 ' HB3' ' B' ' 43' ' ' LEU . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.41 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' B' ' 61' ' ' ILE . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.71 ' CD2' HD22 ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 92' ' ' GLN . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.287 0.565 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.657 ' HB3' HG13 ' B' ' 70' ' ' VAL . 80.0 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.545 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.66 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.54 HD13 HG21 ' B' ' 17' ' ' VAL . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.556 HD11 ' OE2' ' B' ' 34' ' ' GLU . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.775 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.775 HD12 ' C ' ' B' ' 14' ' ' THR . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.54 HG21 HD13 ' B' ' 3' ' ' ILE . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.706 ' O ' HD12 ' B' ' 56' ' ' LEU . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.504 ' HB3' HD23 ' B' ' 15' ' ' LEU . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD13 ' B' ' 69' ' ' LEU . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' GLU . . . . . 0.556 ' OE2' HD11 ' B' ' 13' ' ' ILE . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.799 ' HB3' HD12 ' B' ' 50' ' ' LEU . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.623 ' HB2' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.706 HD12 ' O ' ' B' ' 18' ' ' GLU . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.509 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.707 ' N ' HD22 ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.486 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 92' ' ' GLN . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.835 0.35 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.77 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 24' ' ' LEU . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.692 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.692 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.587 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.587 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.153 0.502 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.671 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.2 mt-30 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.763 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.752 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.48 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.413 HG22 ' CD2' ' B' ' 69' ' ' LEU . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.763 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 30' ' ' ILE . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.586 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.534 ' O ' HD12 ' B' ' 56' ' ' LEU . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.586 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.427 HG12 HD11 ' B' ' 15' ' ' LEU . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.49 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.791 ' C ' HD12 ' B' ' 44' ' ' ILE . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.546 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.69 HD22 ' CG ' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.435 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' B' ' 61' ' ' ILE . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.69 ' CG ' HD22 ' B' ' 50' ' ' LEU . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.546 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.671 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 26' ' ' LEU . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.365 0.602 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.959 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.959 ' N ' HD13 ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 4.7 mm-40 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.811 ' CD2' HD13 ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.709 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.518 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.577 HD12 HD22 ' B' ' 67' ' ' LEU . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.532 HD11 HG12 ' B' ' 30' ' ' ILE . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.598 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.544 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.42 ' CE ' HG22 ' B' ' 23' ' ' ILE . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.598 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.532 HG12 HD11 ' B' ' 15' ' ' LEU . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.487 ' C ' HD22 ' B' ' 43' ' ' LEU . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.487 HD22 ' C ' ' B' ' 42' ' ' ARG . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.709 HG21 ' HB1' ' A' ' 96' ' ' ALA . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.787 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.481 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.62 ' HA ' HD12 ' B' ' 61' ' ' ILE . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.787 ' CG ' HD22 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 3' ' ' ILE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.607 HG13 ' HB3' ' A' ' 92' ' ' GLN . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.726 0.298 . . . . 0.0 110.592 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' A' ' 26' ' ' LEU . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 24' ' ' LEU . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG2' ' HA ' ' A' ' 29' ' ' SER . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.689 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.689 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.276 0.56 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 71' ' ' ILE . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 47.7 mt-30 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.649 ' CD2' HD13 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.445 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.494 HD13 HG21 ' B' ' 17' ' ' VAL . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.7 ' CE1' HG23 ' B' ' 14' ' ' THR . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.649 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 13' ' ' ILE . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.7 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.494 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.668 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.632 HG23 HD12 ' B' ' 43' ' ' LEU . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.498 HG23 ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.498 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.427 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.632 HD12 HG23 ' B' ' 23' ' ' ILE . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.646 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.429 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.668 HD12 ' O ' ' B' ' 18' ' ' GLU . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.646 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.429 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.523 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.652 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.652 ' N ' HD23 ' B' ' 69' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mt . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.421 ' HA ' HD12 ' A' ' 26' ' ' LEU . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.28 0.562 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.971 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.971 ' N ' HD13 ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.689 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.693 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.596 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.489 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.595 HD12 HD22 ' B' ' 67' ' ' LEU . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.693 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.769 ' C ' HD12 ' B' ' 15' ' ' LEU . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.769 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.489 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.606 HG23 HD12 ' B' ' 43' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.474 ' CD ' HG12 ' B' ' 17' ' ' VAL . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.452 HG23 ' HD2' ' B' ' 37' ' ' PRO . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.455 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.455 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.672 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.672 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.808 HD22 ' CD2' ' B' ' 59' ' ' TYR . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' B' ' 61' ' ' ILE . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.808 ' CD2' HD22 ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.432 HD12 ' HA ' ' B' ' 56' ' ' LEU . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.595 HD22 HD12 ' B' ' 3' ' ' ILE . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 92' ' ' GLN . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.715 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 24' ' ' LEU . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.195 0.521 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.663 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.629 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.3 mt-30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.752 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD2' HD13 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.738 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.463 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' ILE . . . . . 0.41 HD12 HD22 ' B' ' 67' ' ' LEU . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' B' ' 12' ' ' THR . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.589 ' HG2' HG23 ' B' ' 12' ' ' THR . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.492 HG22 HD23 ' B' ' 69' ' ' LEU . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.589 HG23 ' HG2' ' B' ' 6' ' ' LYS . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.481 HD11 HG12 ' B' ' 30' ' ' ILE . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.624 HG12 ' HD3' ' B' ' 29' ' ' LYS . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.696 HG23 HD12 ' B' ' 43' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.414 ' HE2' HG22 ' B' ' 23' ' ' ILE . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.624 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.481 HG12 HD11 ' B' ' 15' ' ' LEU . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.752 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.798 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.798 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.472 ' HB3' HD21 ' B' ' 50' ' ' LEU . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.649 HD22 ' CG ' ' B' ' 59' ' ' TYR . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.488 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.649 ' CG ' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.446 HD23 HD22 ' B' ' 43' ' ' LEU . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.492 HD23 HG22 ' B' ' 7' ' ' THR . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.629 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 24' ' ' LEU . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.204 0.526 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 66' ' ' LEU . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.711 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.493 HD11 ' CZ ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.74 ' CD2' HD13 ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.792 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.409 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 14' ' ' THR . . . . . 0.725 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.725 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 1' ' ' MET . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' VAL . . . . . 0.571 HG21 HD21 ' B' ' 56' ' ' LEU . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.604 HD13 HD12 ' B' ' 69' ' ' LEU . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.493 ' CZ ' HD11 ' A' ' 93' ' ' ILE . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.784 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.792 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 67' ' ' LEU . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.782 HD22 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.782 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.715 HD12 ' HA ' ' B' ' 56' ' ' LEU . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.621 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.711 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.69 HD23 ' O ' ' A' ' 24' ' ' LEU . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 26' ' ' LEU . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 24' ' ' LEU . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 N--CA 1.493 1.725 0 CA-C-O 121.216 0.531 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 71' ' ' ILE . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' LYS . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.49 ' HB3' HG13 ' B' ' 70' ' ' VAL . 75.1 mt-30 . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.614 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.457 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.881 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.452 HG22 HD23 ' B' ' 69' ' ' LEU . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.881 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.5 HD11 HG12 ' B' ' 30' ' ' ILE . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.594 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.477 ' O ' HD12 ' B' ' 56' ' ' LEU . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.689 HG22 ' HE2' ' B' ' 27' ' ' LYS . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.689 ' HE2' HG22 ' B' ' 23' ' ' ILE . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.594 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 15' ' ' LEU . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' B' ' 29' ' ' LYS . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.412 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' B' ' 37' ' ' PRO . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.614 ' NE ' HD11 ' A' ' 93' ' ' ILE . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.78 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.465 HG13 ' HB3' ' A' ' 96' ' ' ALA . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.78 HD12 ' HB3' ' B' ' 43' ' ' LEU . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.453 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.492 HD22 HG21 ' B' ' 61' ' ' ILE . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.549 ' CG ' HD22 ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.492 HG21 HD22 ' B' ' 56' ' ' LEU . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.505 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.452 HD23 HG22 ' B' ' 7' ' ' THR . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 92' ' ' GLN . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.487 ' N ' HD22 ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 24' ' ' LEU . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE2' HG12 ' A' ' 28' ' ' VAL . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.561 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.219 0.533 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 66' ' ' LEU . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.626 ' HB3' HG13 ' B' ' 70' ' ' VAL . 63.6 mt-30 . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.485 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.716 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.598 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HG2' HG23 ' B' ' 12' ' ' THR . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' LEU . . . . . 0.512 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.426 HG23 ' HG2' ' B' ' 6' ' ' LYS . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.601 HD23 ' HE3' ' B' ' 33' ' ' LYS . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.598 HG23 ' SD ' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' ILE . . . . . 0.567 HG23 HD12 ' B' ' 43' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LYS . . . . . 0.484 ' HE2' HG22 ' B' ' 23' ' ' ILE . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LYS . . . . . 0.544 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.568 HG12 HD11 ' B' ' 15' ' ' LEU . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LYS . . . . . 0.601 ' HE3' HD23 ' B' ' 15' ' ' LEU . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.537 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' GLN . . . . . 0.537 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.485 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' PHE . . . . . 0.552 ' HB2' HD23 ' B' ' 67' ' ' LEU . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.677 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' TYR . . . . . 0.677 ' CG ' HD22 ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ILE . . . . . 0.599 HD13 HD21 ' B' ' 67' ' ' LEU . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' SER . . . . . 0.412 ' HB3' HG23 ' B' ' 61' ' ' ILE . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.599 HD21 HD13 ' B' ' 61' ' ' ILE . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 92' ' ' GLN . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.156 0.503 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -148.19 -168.31 3.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.452 -0.78 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.3 mt -112.46 27.53 9.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.412 -0.805 . . . . 0.0 109.423 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.38 -39.28 5.1 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -148.87 33.81 0.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -1.089 . . . . 0.0 110.23 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -114.94 -80.25 0.89 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.23 25.08 11.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.341 -1.094 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 p -119.88 28.74 7.93 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.84 . . . . 0.0 110.16 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.4 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 6.4 p-10 -124.2 26.99 7.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.312 -0.868 . . . . 0.0 110.156 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.4 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 95.9 m-85 -123.71 0.3 8.68 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.367 -0.833 . . . . 0.0 110.563 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -59.91 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.183 -0.948 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 52.26 27.32 4.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.314 -0.866 . . . . 0.0 110.462 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.18 28.56 4.8 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.03 -51.98 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -1.079 . . . . 0.0 109.98 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.537 ' OD1' ' HB2' ' A' ' 18' ' ' ALA . 11.2 p-10 -162.72 154.29 15.21 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.378 -0.826 . . . . 0.0 110.124 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.09 -30.89 12.91 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 O-C-N 123.775 1.408 . . . . 0.0 110.605 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 m -72.33 -6.88 46.35 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.265 -0.897 . . . . 0.0 110.8 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.537 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . . . -84.29 3.28 36.27 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.148 -0.97 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.6 120.14 0.59 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.108 -0.995 . . . . 0.0 109.937 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.775 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -72.45 -20.31 61.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.19 19.11 8.42 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.234 -0.916 . . . . 0.0 110.395 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.3 -43.24 1.63 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.986 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.93 -43.18 5.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 110.088 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -113.55 71.25 0.23 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.5 tt -61.14 -18.31 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.332 -1.099 . . . . 0.0 110.459 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.73 -173.16 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.316 -0.865 . . . . 0.0 110.394 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -58.12 162.49 3.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.272 -0.892 . . . . 0.0 110.374 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.5 m -152.71 -58.24 0.14 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.443 -0.786 . . . . 0.0 110.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.62 -56.54 0.02 OUTLIER Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.9 p -136.11 90.12 2.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -1.069 . . . . 0.0 110.105 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.6 52.73 1.94 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.326 -0.859 . . . . 0.0 110.217 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -53.66 4.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.353 -0.842 . . . . 0.0 110.231 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.84 73.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.378 -0.827 . . . . 0.0 110.284 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -74.53 -62.71 1.43 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -85.14 -51.17 6.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.27 -27.79 69.58 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.382 -0.824 . . . . 0.0 110.12 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 76' ' ' PHE . 53.5 t80 -95.62 36.57 1.26 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.354 -0.841 . . . . 0.0 110.271 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -123.27 89.93 0.42 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 52.66 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.408 -1.054 . . . . 0.0 110.436 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.99 29.02 5.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.477 -0.764 . . . . 0.0 110.19 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.477 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -97.91 25.52 27.15 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -161.5 150.13 12.94 Favored Pre-proline 0 N--CA 1.485 1.323 0 O-C-N 121.477 -1.014 . . . . 0.0 108.525 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 53.6 Cg_endo -77.78 31.45 0.43 Allowed 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 123.473 1.249 . . . . 0.0 110.832 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 39.7 m-20 60.14 149.29 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.83 . . . . 0.0 110.208 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.744 HD22 HD13 ' B' ' 8' ' ' LEU . 96.7 mt -135.66 -72.63 0.46 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.266 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -73.15 -7.01 49.52 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.412 -0.805 . . . . 0.0 110.667 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.7 m -79.63 -20.32 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.91 . . . . 0.0 110.17 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.45 ' HB2' ' HB3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -108.43 -142.5 0.38 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.268 -0.895 . . . . 0.0 110.122 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.2 p -135.1 179.73 6.14 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.886 -1.134 . . . . 0.0 110.76 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.9 pt-20 -66.05 -29.38 69.72 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.575 -0.703 . . . . 0.0 109.361 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.513 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.8 mp0 -78.44 -40.97 34.16 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 87' ' ' MET . 0.2 OUTLIER -64.3 -42.13 96.52 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.15 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.484 ' HB3' HG13 ' B' ' 70' ' ' VAL . 37.4 mt-30 -69.17 -33.92 74.14 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.642 ' CD2' HD23 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.529 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -68.87 -35.97 77.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.578 ' SD ' HD12 ' B' ' 44' ' ' ILE . 0.0 OUTLIER -74.5 -32.68 62.59 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.15 -28.63 67.47 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.016 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 8.1 mtt -93.45 -30.28 15.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 110.153 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.3 m -60.87 -56.7 18.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.149 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.424 ' C ' HD12 ' A' ' 101' ' ' LEU . 3.7 pp -69.88 -12.03 61.31 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.404 -0.81 . . . . 0.0 110.496 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -101.07 34.12 2.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.247 -0.908 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.82 -80.35 1.06 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -101.64 89.1 3.59 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.364 -1.08 . . . . 0.0 110.192 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.89 78.14 1.58 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.345 -0.847 . . . . 0.0 110.18 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -112.88 64.27 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.335 -0.853 . . . . 0.0 110.078 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 134.91 -30.25 2.86 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 89.49 3.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.393 -1.063 . . . . 0.0 110.057 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.15 -139.95 0.38 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.951 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -111.7 59.66 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.166 -0.959 . . . . 0.0 110.27 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.1 m -84.96 158.15 20.61 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.187 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.784 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.744 HD13 HD22 ' A' ' 84' ' ' LEU . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.74 HD23 ' HE3' ' B' ' 33' ' ' LYS . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.784 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.405 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.578 HG23 HD12 ' B' ' 43' ' ' LEU . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.621 HG12 HD11 ' B' ' 15' ' ' LEU . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.74 ' HE3' HD23 ' B' ' 15' ' ' LEU . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.525 HG23 ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.73 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.578 HD12 ' SD ' ' A' ' 97' ' ' MET . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.497 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.423 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' B' ' 56' ' ' LEU . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' B' ' 45' ' ' PHE . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.529 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.512 HG22 ' HB2' ' A' ' 96' ' ' ALA . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt -94.07 129.51 40.58 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -103.06 124.87 49.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.319 -0.863 . . . . 0.0 110.167 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.02 86.81 2.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.82 32.77 0.4 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.289 -0.882 . . . . 0.0 110.067 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.4 114.75 1.34 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.603 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.193 0.52 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.34 -175.52 5.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -109.82 15.26 22.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.444 -0.785 . . . . 0.0 109.913 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.19 -44.68 6.92 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.1 mt -109.03 -23.13 11.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -1.086 . . . . 0.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -70.32 -63.59 3.2 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.41 36.57 20.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.29 -1.123 . . . . 0.0 110.305 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.5 p -166.13 -37.32 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.465 -0.772 . . . . 0.0 110.392 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -49.86 -28.5 6.58 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.274 -0.891 . . . . 0.0 110.516 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -102.25 89.92 3.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.395 -0.816 . . . . 0.0 109.974 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.76 72.06 1.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.341 -0.849 . . . . 0.0 110.454 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 51.32 25.63 2.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.366 -0.833 . . . . 0.0 110.551 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -121.97 47.8 1.0 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.4 t -135.48 -66.73 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -1.089 . . . . 0.0 110.08 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -155.54 155.75 30.05 Favored Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.355 -0.841 . . . . 0.0 110.109 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.05 -15.56 29.08 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 O-C-N 123.841 1.443 . . . . 0.0 110.666 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -6.65 49.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.234 -0.916 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.68 1.91 53.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.124 -0.985 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.22 113.71 1.42 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.0 109.995 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.52 -23.94 64.96 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.412 ' HB1' ' CG1' ' A' ' 54' ' ' ILE . . . -107.89 -10.63 15.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.344 -0.848 . . . . 0.0 110.514 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.35 -46.19 80.07 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.221 -0.924 . . . . 0.0 110.117 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -107.08 21.53 17.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.467 -0.77 . . . . 0.0 110.244 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.56 -43.65 0.49 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.412 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 1.2 pt -139.77 76.91 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -1.1 . . . . 0.0 110.351 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.75 101.12 3.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.091 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.0 t -159.01 148.1 18.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.38 -0.825 . . . . 0.0 110.329 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 20.9 p -127.63 77.88 1.78 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.81 94.63 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.542 HG23 ' O ' ' A' ' 59' ' ' THR . 7.7 t -73.2 67.13 0.92 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.386 -1.067 . . . . 0.0 110.335 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 76.16 0.97 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.342 -0.849 . . . . 0.0 110.144 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -166.62 -41.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.406 -0.809 . . . . 0.0 110.022 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.518 ' HB2' ' HB3' ' A' ' 65' ' ' ALA . 4.8 p -110.9 67.68 0.65 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.384 -0.822 . . . . 0.0 110.097 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -76.67 -53.53 7.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.285 -0.884 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 62' ' ' SER . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.402 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -83.69 -46.33 12.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.0 -42.67 99.4 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.285 -0.884 . . . . 0.0 110.197 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -111.58 47.3 1.04 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.402 -0.811 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.15 -46.92 0.68 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -87.12 125.4 34.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.268 -1.136 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.9 m -154.12 45.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.845 . . . . 0.0 110.107 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.05 56.39 0.94 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.66 147.71 1.69 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.3 -1.118 . . . . 0.0 108.903 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.35 62.7 2.76 Favored 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 123.584 1.307 . . . . 0.0 110.392 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -59.48 99.58 0.06 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.387 -0.821 . . . . 0.0 110.178 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 mp -60.81 -41.04 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.39 -0.819 . . . . 0.0 110.315 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.6 m -59.89 -32.58 70.86 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.372 -0.83 . . . . 0.0 110.379 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 t -82.5 -30.27 29.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 110.042 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.41 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 16.0 mtp -76.45 117.67 18.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.455 -0.778 . . . . 0.0 110.083 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.446 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 66.9 p -80.16 -162.27 0.43 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.799 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.403 ' CB ' ' HA ' ' B' ' 72' ' ' ARG . 16.9 pt-20 -68.69 -31.98 71.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.488 -0.758 . . . . 0.0 109.53 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.6 pt-20 -85.55 -36.87 20.18 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 0.5 OUTLIER -66.26 -48.03 71.8 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.206 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.646 ' HB3' HG13 ' B' ' 70' ' ' VAL . 60.4 mt-30 -63.27 -33.73 76.13 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.623 ' CD2' HD23 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.597 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -82.79 -25.5 32.69 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 93' ' ' ILE . 3.4 ttm -84.11 -30.95 25.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.111 -0.993 . . . . 0.0 110.017 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -82.91 -27.01 30.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.449 -0.782 . . . . 0.0 110.515 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 21.9 ttp -91.69 -17.17 25.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.9 . . . . 0.0 110.579 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 72.4 m -93.14 -27.55 16.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.269 -0.894 . . . . 0.0 110.458 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.49 ' C ' HD23 ' A' ' 101' ' ' LEU . 0.3 OUTLIER -59.28 -27.25 65.66 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.41 -0.806 . . . . 0.0 109.754 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLN . . . . . 0.474 ' N ' HD23 ' A' ' 101' ' ' LEU . 0.0 OUTLIER -105.36 -70.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.9 63.61 1.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -109.14 73.93 0.88 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.363 -1.081 . . . . 0.0 110.245 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -89.31 -62.41 1.49 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.239 -0.913 . . . . 0.0 110.164 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -133.62 -76.13 0.48 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.367 -0.833 . . . . 0.0 110.242 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.26 27.79 63.43 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -133.1 96.13 3.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -1.133 . . . . 0.0 110.235 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -169.19 52.85 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.371 -0.83 . . . . 0.0 109.991 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -151.53 29.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.368 -0.833 . . . . 0.0 110.258 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -165.0 171.11 14.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.383 -0.823 . . . . 0.0 110.124 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.255 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.803 HD13 HG21 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' B' ' 12' ' ' THR . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.576 HG23 ' CE1' ' B' ' 4' ' ' PHE . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.803 HG21 HD13 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.748 HG23 HD12 ' B' ' 43' ' ' LEU . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.616 ' HE3' HG22 ' B' ' 23' ' ' ILE . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' B' ' 17' ' ' VAL . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.52 HG23 ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.52 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.748 HD12 HG23 ' B' ' 23' ' ' ILE . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.597 HG21 ' C ' ' A' ' 96' ' ' ALA . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.626 HD22 ' CG ' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.507 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.626 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.446 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 92' ' ' GLN . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 71' ' ' LEU . 10.1 mt -93.99 125.37 38.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.403 ' HA ' ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -99.0 176.8 5.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 40.3 mt -125.28 151.16 46.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.366 -0.834 . . . . 0.0 110.189 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -150.46 73.55 1.14 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.893 . . . . 0.0 110.182 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.05 33.79 86.45 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.55 -179.964 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.169 0.509 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 9.3 mtp -129.62 173.58 10.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.871 . . . . 0.0 110.347 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.47 23.29 14.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.814 . . . . 0.0 109.568 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.34 74.67 2.49 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.04 80.95 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.403 -1.057 . . . . 0.0 110.045 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.0 -122.5 0.77 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.82 92.04 1.52 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.318 -1.107 . . . . 0.0 110.255 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.89 -43.96 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.401 -0.812 . . . . 0.0 110.184 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -80.24 -27.19 38.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.41 -0.806 . . . . 0.0 110.193 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.583 ' HD2' HG11 ' A' ' 14' ' ' VAL . 28.8 p90 -169.42 125.4 0.87 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.347 -0.846 . . . . 0.0 110.112 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.65 43.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 110.308 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -124.63 61.87 1.14 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.999 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 22' ' ' LEU . . . 124.27 -28.66 5.27 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.583 HG11 ' HD2' ' A' ' 10' ' ' PHE . 11.8 p -69.93 -27.02 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -1.088 . . . . 0.0 110.27 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -134.69 139.77 33.41 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.22 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.66 -12.04 28.61 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.591 1.311 . . . . 0.0 110.804 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -7.82 52.79 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.16 -0.962 . . . . 0.0 110.517 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -113.64 12.15 18.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.157 -0.964 . . . . 0.0 110.54 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.48 117.43 0.55 Allowed Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.535 HD22 ' HA2' ' A' ' 13' ' ' GLY . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.797 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 24' ' ' LEU . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.552 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -67.51 -25.69 65.97 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.18 -28.25 57.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.325 -0.859 . . . . 0.0 110.214 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -113.09 35.47 3.92 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.355 -0.841 . . . . 0.0 110.221 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -166.13 -52.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.28 -0.888 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.22 -21.93 77.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.7 tp -58.4 -25.58 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.299 -1.118 . . . . 0.0 110.409 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 56' ' ' THR . . . -124.18 74.27 1.29 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.342 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 55' ' ' ALA . 6.3 p -153.64 58.83 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 91.7 m -157.52 125.22 5.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.366 -0.834 . . . . 0.0 110.216 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.15 -74.46 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.2 p -145.4 69.59 1.24 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.358 -1.083 . . . . 0.0 110.272 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -83.67 60.74 5.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.312 -0.868 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -82.65 -57.42 3.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.182 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.479 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 60.4 m -126.05 89.83 3.09 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.429 -0.795 . . . . 0.0 110.161 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.12 -32.27 73.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 110.252 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.479 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -90.32 -36.94 14.37 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.11 -39.75 32.86 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.352 -0.843 . . . . 0.0 110.289 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -92.57 -18.61 22.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.385 -0.822 . . . . 0.0 110.595 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.37 -55.49 30.14 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -108.91 126.33 52.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -1.074 . . . . 0.0 110.105 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 9.28 43.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 110.567 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.458 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -88.84 57.89 4.05 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.59 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -161.47 41.84 0.09 OUTLIER Pre-proline 0 C--N 1.307 -1.279 0 O-C-N 121.424 -1.045 . . . . 0.0 110.274 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 46.3 Cg_endo -70.05 -10.16 27.7 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 N-CA-C 108.532 -1.372 . . . . 0.0 108.532 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.7 101.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.827 -0.546 . . . . 0.0 110.431 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.7 mt -91.08 -38.14 12.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.39 -0.819 . . . . 0.0 110.179 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.8 m -70.27 -11.65 61.05 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.562 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.6 m -92.98 -24.83 18.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.297 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.456 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 36.4 mtm -84.19 124.23 30.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.178 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -78.23 -165.45 0.68 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.459 -0.775 . . . . 0.0 110.591 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.6 pt-20 -65.75 -31.31 72.23 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.442 -0.786 . . . . 0.0 109.248 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.503 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 46.5 mt-10 -84.64 -41.2 16.58 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 4.3 tp10 -62.74 -45.93 90.45 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.628 ' HB3' HG13 ' B' ' 70' ' ' VAL . 79.6 mt-30 -65.2 -36.28 83.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.545 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.83 ' CD2' HD23 ' B' ' 8' ' ' LEU . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.726 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -83.0 -32.15 27.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.634 ' O ' HD12 ' A' ' 101' ' ' LEU . 7.4 mtt -83.7 -24.21 31.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.366 -0.834 . . . . 0.0 110.094 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.409 ' CB ' ' O ' ' A' ' 94' ' ' ALA . 8.3 tp60 -82.28 -36.22 27.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.412 -0.805 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.445 ' HE2' ' CZ ' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -82.9 -24.18 33.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.875 . . . . 0.0 110.312 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.6 m -82.26 -28.31 31.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.354 -0.841 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.634 HD12 ' O ' ' A' ' 97' ' ' MET . 6.5 mt -93.33 15.85 14.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -107.85 -27.54 10.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.93 . . . . 0.0 110.154 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -79.3 -77.62 0.9 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.71 75.34 0.84 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.293 -1.121 . . . . 0.0 110.136 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -65.76 -68.19 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.294 -0.879 . . . . 0.0 110.333 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.89 -48.21 0.8 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.31 -0.869 . . . . 0.0 110.078 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.47 -104.99 0.48 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -116.19 54.51 0.83 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.326 -1.103 . . . . 0.0 110.214 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.82 79.02 0.12 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.362 -0.836 . . . . 0.0 110.478 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -106.79 50.68 0.76 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 110.121 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.2 p -68.28 109.92 3.82 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.189 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.226 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.83 HD23 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.715 ' C ' HD12 ' B' ' 15' ' ' LEU . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.715 HD12 ' C ' ' B' ' 14' ' ' THR . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.405 HG12 ' CD ' ' B' ' 29' ' ' LYS . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.452 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.582 HG23 HD12 ' B' ' 43' ' ' LEU . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.523 ' HE2' HG22 ' B' ' 23' ' ' ILE . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.405 ' CD ' HG12 ' B' ' 17' ' ' VAL . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.4 ' CE ' ' HG ' ' B' ' 15' ' ' LEU . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.541 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' B' ' 72' ' ' ARG . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.545 ' NE ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.787 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.787 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 101' ' ' LEU . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.458 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' B' ' 61' ' ' ILE . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.734 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.569 HD12 ' HA ' ' B' ' 56' ' ' LEU . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.41 HD21 HD13 ' B' ' 61' ' ' ILE . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.628 HG13 ' HB3' ' A' ' 92' ' ' GLN . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 71' ' ' LEU . 12.7 mt -94.07 117.03 29.52 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 18.5 ttt-85 -90.26 100.56 13.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.279 -0.888 . . . . 0.0 110.157 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mp -71.33 -173.07 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -164.6 95.9 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.287 -0.883 . . . . 0.0 110.312 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.32 -65.86 3.0 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 117.996 -1.447 . . . . 0.0 109.579 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.146 0.498 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtp -60.86 -178.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.428 -0.795 . . . . 0.0 110.259 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.72 23.62 13.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.748 . . . . 0.0 109.56 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.3 -8.18 78.49 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.7 -33.32 66.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -1.223 . . . . 0.0 110.269 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -96.37 130.86 10.41 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 10.46 22.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.446 -1.032 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 p -113.16 -18.58 12.09 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.916 . . . . 0.0 110.296 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.74 -24.04 55.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.899 . . . . 0.0 110.43 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 31.1 p90 -160.8 119.55 2.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 0.0 110.314 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.27 66.83 1.53 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.475 -0.765 . . . . 0.0 110.032 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 52.65 36.56 21.18 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.291 -0.88 . . . . 0.0 110.428 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.79 17.12 3.26 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -129.53 -26.45 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -1.091 . . . . 0.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.555 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -56.48 -178.7 0.07 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.293 -0.88 . . . . 0.0 110.277 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.804 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.2 Cg_endo -62.01 79.91 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.601 1.316 . . . . 0.0 110.497 -178.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.1 45.98 0.66 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.321 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.51 27.62 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.145 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -161.43 105.33 1.21 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.087 -1.008 . . . . 0.0 110.54 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.804 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 24' ' ' LEU . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.541 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -69.14 -24.68 64.12 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.33 -28.93 24.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.308 -0.87 . . . . 0.0 110.161 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -87.6 100.22 12.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.384 -0.822 . . . . 0.0 110.274 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.38 32.32 13.61 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.516 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.39 -37.18 0.65 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.634 HG23 ' O ' ' A' ' 54' ' ' ILE . 11.3 tt -66.87 79.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -1.071 . . . . 0.0 110.267 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.55 132.01 56.76 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.254 -0.904 . . . . 0.0 110.197 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -76.2 -172.04 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.404 -0.81 . . . . 0.0 110.252 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.6 p -74.65 103.2 4.85 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.327 -0.858 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.88 -112.17 1.08 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.3 m -154.45 74.67 0.96 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.272 -1.134 . . . . 0.0 110.301 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -139.77 43.7 1.96 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.51 -42.64 5.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.529 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 6.5 m -102.93 70.1 1.07 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.427 -0.796 . . . . 0.0 110.161 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -77.68 -60.72 2.25 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.267 -0.895 . . . . 0.0 110.184 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.529 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.97 -42.21 15.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 76' ' ' PHE . 15.0 pt-20 -64.15 -37.98 89.41 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.256 -0.903 . . . . 0.0 110.09 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.416 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 61.8 t80 -82.56 -29.62 30.19 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.462 -0.774 . . . . 0.0 110.188 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.8 -35.21 84.76 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.3 mtt180 -105.9 -24.0 12.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -1.098 . . . . 0.0 110.445 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.658 HG22 ' O ' ' A' ' 79' ' ' THR . 96.5 m 52.33 25.66 3.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.239 -0.913 . . . . 0.0 110.136 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.485 ' O ' HD23 ' A' ' 81' ' ' LEU . . . 99.97 -92.53 1.13 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 80' ' ' GLY . 95.6 mt -153.08 143.27 15.38 Favored Pre-proline 0 N--CA 1.487 1.397 0 O-C-N 121.582 -0.952 . . . . 0.0 108.456 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -75.84 50.15 2.69 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.512 1.27 . . . . 0.0 110.359 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -59.04 119.43 7.26 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD22 HD13 ' B' ' 8' ' ' LEU . 43.9 mt -80.05 -29.32 39.21 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.385 -0.822 . . . . 0.0 110.155 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -61.26 -32.22 72.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -0.826 . . . . 0.0 110.132 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m -84.1 -27.94 27.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.286 -0.884 . . . . 0.0 109.998 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.6 mtt -81.24 119.18 23.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.449 -0.782 . . . . 0.0 110.008 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.442 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 75.6 p -74.55 -168.08 0.64 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.467 -0.771 . . . . 0.0 110.382 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.559 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -67.11 -28.34 68.08 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.529 -0.732 . . . . 0.0 109.237 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.493 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.7 mt-10 -85.4 -41.75 15.15 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.442 ' HB2' ' N ' ' A' ' 88' ' ' THR . 5.1 mm-40 -63.73 -42.96 97.8 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.609 ' HB3' HG13 ' B' ' 70' ' ' VAL . 39.5 mt-30 -68.52 -33.8 74.76 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.559 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.789 ' CD2' HD23 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.625 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -76.58 -33.16 58.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.401 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 55.5 mtt -79.27 -23.24 43.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.313 -0.867 . . . . 0.0 109.661 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -81.84 -26.53 34.2 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.471 -0.768 . . . . 0.0 110.177 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.483 ' HE2' ' CE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -94.11 -21.77 18.91 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.354 -0.841 . . . . 0.0 110.34 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m -87.1 -23.32 24.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.401 -0.812 . . . . 0.0 110.147 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.566 HD13 ' HA3' ' B' ' 47' ' ' GLY . 7.5 tp -86.87 8.88 21.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.367 -0.833 . . . . 0.0 110.523 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.07 34.95 1.73 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.64 74.63 0.38 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.8 93.86 1.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.37 -1.077 . . . . 0.0 110.335 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -107.92 -50.17 3.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.327 -0.858 . . . . 0.0 110.124 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 60.59 38.97 18.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.398 -0.814 . . . . 0.0 109.95 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.72 120.84 24.53 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.85 88.3 3.16 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.377 -1.072 . . . . 0.0 110.276 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -170.54 123.25 0.65 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.321 -0.862 . . . . 0.0 110.233 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -64.53 -39.02 92.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.35 -0.844 . . . . 0.0 110.127 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -153.94 -58.04 0.12 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.884 . . . . 0.0 110.264 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.207 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.694 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.705 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.789 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.705 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.694 HG23 ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.476 ' O ' HD12 ' B' ' 56' ' ' LEU . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.595 HG23 HD12 ' B' ' 43' ' ' LEU . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.416 ' CD ' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.503 HG23 ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.409 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.437 ' HB2' ' HB ' ' B' ' 70' ' ' VAL . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.802 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.643 ' HB2' HD23 ' B' ' 67' ' ' LEU . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.566 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.523 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.598 ' CD2' HD22 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.581 HD12 ' HA ' ' B' ' 56' ' ' LEU . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.643 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.665 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.665 ' N ' HD23 ' B' ' 69' ' ' LEU . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt -94.11 136.53 34.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -125.64 146.0 49.91 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.359 -0.838 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.99 162.31 23.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 110.129 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 76.23 10.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.411 -0.806 . . . . 0.0 110.19 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 167.24 -86.83 0.1 OUTLIER Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 117.956 -1.469 . . . . 0.0 109.559 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 4.8 m80 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.157 0.503 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.519 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.2 mtp -165.55 -178.64 5.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.386 -0.821 . . . . 0.0 110.141 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 3' ' ' LEU . 7.3 mp -112.27 24.28 12.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.621 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.94 67.67 3.64 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.78 -34.97 30.08 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.366 -1.079 . . . . 0.0 110.148 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.65 174.83 28.18 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.6 32.86 2.17 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.418 -1.048 . . . . 0.0 110.164 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.7 p -100.39 18.16 19.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.344 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.2 -22.88 35.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.256 -0.902 . . . . 0.0 110.194 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.787 ' HB2' HG21 ' A' ' 14' ' ' VAL . 37.4 p90 -166.68 121.47 1.11 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.799 . . . . 0.0 110.098 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -170.43 50.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.255 -0.903 . . . . 0.0 110.688 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.785 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 53.5 p90 -153.45 -39.81 0.1 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.242 -0.911 . . . . 0.0 110.471 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.492 ' N ' ' CD1' ' A' ' 12' ' ' PHE . . . -131.01 34.6 2.6 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.787 HG21 ' HB2' ' A' ' 10' ' ' PHE . 54.1 t -110.36 -50.59 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.412 -1.052 . . . . 0.0 110.311 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.547 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -64.99 178.7 0.47 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.812 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.4 Cg_endo -59.85 77.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.702 1.37 . . . . 0.0 111.23 -178.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 67.88 45.17 1.43 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.728 0.775 . . . . 0.0 108.945 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.785 ' HB2' ' O ' ' A' ' 12' ' ' PHE . . . 40.23 31.14 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.127 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -160.28 111.51 1.39 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.294 -0.879 . . . . 0.0 110.478 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.812 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.645 ' O ' HG23 ' A' ' 28' ' ' VAL . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 26' ' ' LEU . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 24' ' ' LEU . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.9 -27.69 57.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.03 -10.85 59.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.357 -0.84 . . . . 0.0 110.537 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -95.69 76.07 3.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.185 -0.947 . . . . 0.0 110.28 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.32 25.98 3.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.535 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 21.96 4.23 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.4 tp -78.24 -31.47 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -1.137 . . . . 0.0 110.329 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -96.06 -59.24 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.349 -0.844 . . . . 0.0 110.103 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 37.2 p -134.28 179.96 5.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.371 -0.83 . . . . 0.0 110.195 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.0 p -100.07 128.62 46.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.306 -0.871 . . . . 0.0 110.168 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -145.74 70.2 0.37 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.3 p -71.8 69.87 0.69 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.37 -1.076 . . . . 0.0 110.178 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -107.66 52.08 0.72 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.848 . . . . 0.0 110.23 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -98.31 -32.5 11.5 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.254 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.4 OUTLIER -106.81 77.61 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.339 -0.851 . . . . 0.0 110.248 179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -77.81 -58.34 3.32 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.359 -0.838 . . . . 0.0 110.269 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -78.36 -46.65 19.46 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -64.67 -39.27 93.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.432 -0.793 . . . . 0.0 109.965 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.5 t80 53.75 -92.3 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.474 -0.766 . . . . 0.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.1 37.69 86.91 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.35 103.37 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -1.047 . . . . 0.0 110.392 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.1 m -145.81 40.49 1.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.371 -0.831 . . . . 0.0 110.264 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.675 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -83.39 57.21 5.07 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.675 HD12 ' C ' ' A' ' 80' ' ' GLY . 1.6 mp -157.79 149.44 17.05 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 121.43 -1.041 . . . . 0.0 108.511 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.57 35.72 0.52 Allowed 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.438 1.23 . . . . 0.0 110.975 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.76 63.38 2.25 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.067 -1.021 . . . . 0.0 110.677 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' B' ' 8' ' ' LEU . 9.2 mt -67.16 -47.65 70.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.414 -0.804 . . . . 0.0 110.199 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.52 -3.05 28.56 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 110.683 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.84 -3.84 14.79 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.167 -0.958 . . . . 0.0 110.283 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.9 mtm -85.18 -164.55 1.01 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.243 -0.91 . . . . 0.0 109.96 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.8 p -127.74 -179.81 5.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.308 -0.87 . . . . 0.0 110.518 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.618 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.72 -29.72 70.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.567 -0.708 . . . . 0.0 109.268 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.505 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.3 mt-10 -82.5 -42.33 18.57 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -43.02 99.88 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.479 ' HB3' HG13 ' B' ' 70' ' ' VAL . 32.8 mt-30 -70.02 -33.99 72.72 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.618 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.422 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.747 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -67.75 -32.3 72.8 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 mtp -74.89 -20.56 59.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -79.62 -28.4 40.94 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.515 -0.741 . . . . 0.0 109.988 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 61.2 mtm -102.98 0.87 32.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.45 -0.781 . . . . 0.0 110.629 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 10.8 t -112.81 -17.13 12.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.178 -0.951 . . . . 0.0 110.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.662 HD22 ' HA3' ' B' ' 47' ' ' GLY . 0.1 OUTLIER -59.46 -26.14 64.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 110.311 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -69.75 -57.36 5.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.422 -0.799 . . . . 0.0 110.145 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.69 114.53 3.73 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.47 92.7 3.95 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.43 -1.041 . . . . 0.0 110.163 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -80.0 -56.0 4.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.425 -0.797 . . . . 0.0 110.241 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -163.02 -44.36 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.361 -0.837 . . . . 0.0 110.187 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.06 54.74 0.75 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -69.82 74.66 0.44 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.353 -1.087 . . . . 0.0 110.203 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.24 88.38 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.296 -0.878 . . . . 0.0 110.465 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -122.47 -56.56 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.29 -0.881 . . . . 0.0 110.276 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -100.07 56.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.189 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.564 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.449 HD13 HG21 ' B' ' 17' ' ' VAL . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.456 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.567 HG22 HD23 ' B' ' 69' ' ' LEU . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.774 ' C ' HD12 ' B' ' 15' ' ' LEU . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.774 HD12 ' C ' ' B' ' 14' ' ' THR . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.564 HG23 ' SD ' ' B' ' 1' ' ' MET . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.423 ' O ' HD22 ' B' ' 56' ' ' LEU . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.445 ' O ' HD13 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.79 HG21 HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.535 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.535 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.841 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 96' ' ' ALA . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.644 ' HB3' HD21 ' B' ' 50' ' ' LEU . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.662 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.841 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.805 ' HA ' HD12 ' B' ' 61' ' ' ILE . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.524 ' CG ' HD22 ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.532 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.567 HD23 HG22 ' B' ' 7' ' ' THR . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.45 134.9 36.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.18 129.34 56.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.312 -0.868 . . . . 0.0 110.088 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -90.96 135.1 33.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 110.323 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.58 76.14 6.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.356 -0.84 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 113.13 142.45 8.35 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.956 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.511 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -163.66 -177.91 5.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.424 -0.798 . . . . 0.0 110.177 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.78 25.23 11.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.447 -0.783 . . . . 0.0 109.656 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.22 -125.44 1.03 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.9 mt -127.54 -48.08 1.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.375 -1.074 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.61 24.34 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.71 -33.55 5.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.422 -1.046 . . . . 0.0 110.198 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -86.08 3.04 44.24 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.335 -0.853 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.27 -27.02 24.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.182 -0.949 . . . . 0.0 110.22 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -137.86 106.93 6.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.355 -0.841 . . . . 0.0 110.226 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -131.38 50.97 2.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.44 -0.788 . . . . 0.0 110.275 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -128.8 -63.57 0.96 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.221 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.93 25.18 3.74 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.8 t -118.19 -23.28 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.41 -1.053 . . . . 0.0 110.405 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.563 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -59.36 -179.31 0.15 Allowed Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.309 -0.87 . . . . 0.0 110.132 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.675 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.8 Cg_endo -60.71 78.39 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.271 0 O-C-N 123.542 1.285 . . . . 0.0 111.034 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.465 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 68.86 44.78 1.05 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.819 0.819 . . . . 0.0 108.964 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.74 27.83 0.07 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.332 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.75 110.22 0.47 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.988 . . . . 0.0 110.53 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.456 HD12 ' N ' ' A' ' 22' ' ' LEU . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.675 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.736 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 24' ' ' LEU . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.1 -38.34 66.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.52 70.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.863 . . . . 0.0 110.137 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.13 84.15 5.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.384 -0.823 . . . . 0.0 110.14 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 54.19 27.69 8.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.361 -0.837 . . . . 0.0 110.344 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -114.56 -15.55 8.08 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.781 HD13 ' O ' ' A' ' 54' ' ' ILE . 0.1 OUTLIER -58.2 -34.8 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.182 -1.187 . . . . 0.0 110.157 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.93 97.75 1.48 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.331 -0.856 . . . . 0.0 110.138 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.5 ' O ' HG23 ' A' ' 57' ' ' THR . 27.0 p -120.9 124.85 45.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 0.0 110.24 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 56' ' ' THR . 11.6 p -153.41 112.87 3.82 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.353 -0.842 . . . . 0.0 110.287 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.84 -56.97 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.402 ' O ' HG23 ' A' ' 59' ' ' THR . 6.7 t -154.52 56.36 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.365 -1.079 . . . . 0.0 110.204 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -98.94 60.67 1.24 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.389 -0.819 . . . . 0.0 110.145 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -94.21 -40.32 10.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.359 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.4 m -126.59 95.31 4.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.345 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.36 -30.27 68.28 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.332 -0.855 . . . . 0.0 110.084 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -79.57 -42.96 23.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.05 -38.99 92.63 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.318 -0.864 . . . . 0.0 110.028 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -83.99 -31.46 25.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.367 -0.833 . . . . 0.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.36 64.15 1.73 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 50.68 69.96 0.57 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.362 -1.081 . . . . 0.0 110.774 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.0 t -49.73 -29.83 8.3 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.913 0.863 . . . . 0.0 109.367 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.456 ' O ' HD23 ' A' ' 81' ' ' LEU . . . -165.49 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.485 1.944 0 N-CA-C 107.988 -2.045 . . . . 0.0 107.988 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 80' ' ' GLY . 61.3 mt -155.91 148.6 17.97 Favored Pre-proline 0 N--CA 1.486 1.346 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.83 36.21 0.55 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 123.47 1.247 . . . . 0.0 110.876 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 50.86 86.84 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.175 -0.953 . . . . 0.0 110.654 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.544 HD11 HD22 ' B' ' 8' ' ' LEU . 0.2 OUTLIER -78.46 -31.56 48.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.035 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -22.27 66.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 110.245 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -86.56 -26.52 24.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.405 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 37.8 mtt -69.42 118.93 12.92 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.865 . . . . 0.0 109.98 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -78.36 -160.74 0.22 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.496 -0.753 . . . . 0.0 110.68 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mt-10 -69.07 -33.3 73.32 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.2 mp0 -85.92 -36.81 19.66 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.283 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.67 -45.46 86.64 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 178.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.61 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 -68.36 -34.53 76.24 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.785 ' CD2' HD23 ' B' ' 8' ' ' LEU . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.807 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -70.02 -43.02 72.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.463 ' N ' HG21 ' B' ' 44' ' ' ILE . 29.5 mtt -78.29 -13.12 59.99 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.395 -0.816 . . . . 0.0 110.08 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.74 -49.07 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' MET . . . . . 0.403 ' HB2' ' NE2' ' B' ' 68' ' ' HIS . 6.1 mtm -78.59 -16.5 57.33 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.385 -0.822 . . . . 0.0 110.649 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.7 m -87.32 -29.14 21.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 0.0 110.186 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.414 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -60.45 -24.13 64.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.34 -0.85 . . . . 0.0 110.05 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.61 36.47 2.62 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.443 -0.786 . . . . 0.0 110.066 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.78 -82.06 0.92 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -140.11 94.99 2.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.452 -1.028 . . . . 0.0 110.237 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -153.7 82.08 1.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.306 -0.871 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -137.21 -64.17 0.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.43 -0.794 . . . . 0.0 110.285 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.29 -44.92 0.78 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -123.43 93.18 3.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.393 -1.063 . . . . 0.0 110.32 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.53 -67.86 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -93.05 -34.12 13.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.407 -0.808 . . . . 0.0 110.259 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -96.21 176.06 6.22 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.187 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.215 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.475 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.518 HD13 HG21 ' B' ' 17' ' ' VAL . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.529 HG22 HD23 ' B' ' 69' ' ' LEU . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.785 HD23 ' CD2' ' A' ' 95' ' ' TYR . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.529 ' O ' HD12 ' B' ' 15' ' ' LEU . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.562 HD23 ' HB3' ' B' ' 29' ' ' LYS . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.431 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.562 ' HB3' HD23 ' B' ' 15' ' ' LEU . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.546 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HD2' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.807 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.629 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' B' ' 43' ' ' LEU . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.475 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.431 HD12 ' O ' ' B' ' 18' ' ' GLU . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.579 ' CG ' HD22 ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.629 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.403 ' NE2' ' HB2' ' A' ' 99' ' ' MET . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.529 HD23 HG22 ' B' ' 7' ' ' THR . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.61 HG13 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt -93.69 130.78 39.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.436 ' HA ' ' CG ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -103.76 89.11 3.22 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.441 -0.787 . . . . 0.0 110.035 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.25 172.41 0.62 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.268 -0.895 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.8 33.27 2.6 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.449 -0.782 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.45 -167.19 38.1 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.013 -1.437 . . . . 0.0 109.575 179.952 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.057 0.456 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.6 mtp 53.23 -179.86 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.265 -0.897 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.51 24.77 12.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.418 -0.801 . . . . 0.0 109.627 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.63 -34.73 8.99 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 5' ' ' LEU . 2.9 mm? -107.86 75.3 0.99 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.372 -1.075 . . . . 0.0 110.287 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -129.14 -97.82 0.86 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.96 70.33 1.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.373 -1.075 . . . . 0.0 110.255 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.8 p -156.81 -43.93 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.352 -0.842 . . . . 0.0 110.242 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -69.55 -30.04 67.76 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.442 -0.786 . . . . 0.0 110.113 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.33 103.17 6.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.429 -0.794 . . . . 0.0 110.071 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -108.6 39.36 2.02 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.384 -0.823 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -136.06 15.16 3.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.348 -0.845 . . . . 0.0 110.554 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.67 49.97 55.67 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.9 m -51.54 -25.81 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.432 -1.04 . . . . 0.0 110.425 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -135.43 145.86 55.41 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.998 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.65 -15.79 30.31 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.645 1.339 . . . . 0.0 110.771 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -72.55 -6.29 42.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.299 -0.876 . . . . 0.0 110.703 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 21.42 13.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.114 -0.991 . . . . 0.0 110.337 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -169.55 118.51 0.56 Allowed Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.289 -0.882 . . . . 0.0 109.853 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.69 -25.1 41.32 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.88 -18.42 22.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.31 -0.868 . . . . 0.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -112.01 -42.39 3.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.189 -0.944 . . . . 0.0 110.305 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 48' ' ' SER . . . -88.67 -31.62 18.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.345 -0.847 . . . . 0.0 110.31 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -118.27 51.27 0.76 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 54' ' ' ILE . 14.6 tt -68.3 75.46 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.332 -1.099 . . . . 0.0 110.253 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -154.63 154.12 32.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.297 -0.877 . . . . 0.0 110.079 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 13.3 p -107.55 103.19 12.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.408 -0.808 . . . . 0.0 110.288 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.6 p -104.06 97.69 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.336 -0.853 . . . . 0.0 110.119 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.8 76.69 0.22 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.6 p -85.34 73.9 10.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.415 -1.05 . . . . 0.0 110.135 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 62' ' ' SER . 1.2 mt-10 -102.27 43.62 1.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.432 -0.793 . . . . 0.0 110.5 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.617 ' O ' ' N ' ' A' ' 63' ' ' ASP . 20.7 m-20 -55.74 97.17 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.0 OUTLIER -50.98 78.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.637 0.732 . . . . 0.0 110.85 -177.794 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.617 ' N ' ' O ' ' A' ' 61' ' ' ASP . 5.0 t0 -77.75 -56.95 4.09 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.673 -0.642 . . . . 0.0 110.1 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 70' ' ' THR . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 66' ' ' LEU . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.51 -34.71 31.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -66.0 -53.21 41.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.372 -0.83 . . . . 0.0 110.18 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -61.54 -30.88 70.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.07 -36.76 45.21 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.98 123.06 27.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -1.106 . . . . 0.0 110.124 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -144.79 42.36 1.33 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.452 -0.78 . . . . 0.0 110.272 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -102.4 27.68 19.25 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.599 HD12 ' N ' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -174.81 152.29 1.55 Allowed Pre-proline 0 N--CA 1.488 1.428 0 O-C-N 121.319 -1.106 . . . . 0.0 108.901 179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.87 0.6 Allowed 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.595 1.313 . . . . 0.0 110.885 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.599 ' N ' HD12 ' A' ' 81' ' ' LEU . 1.3 t0 50.71 63.51 2.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.143 -0.973 . . . . 0.0 110.609 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.7 tp -61.93 -34.81 76.77 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.348 -0.845 . . . . 0.0 110.256 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.1 p -60.44 -25.79 66.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.315 -0.866 . . . . 0.0 110.398 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 p -83.76 -23.27 31.61 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.391 -0.818 . . . . 0.0 110.058 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.413 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 15.9 mtt -82.02 118.45 23.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.359 -0.838 . . . . 0.0 109.866 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -76.42 -167.54 0.81 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.382 -0.823 . . . . 0.0 110.621 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.552 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.3 pt-20 -66.57 -29.73 69.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.548 -0.72 . . . . 0.0 109.157 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 47.4 mt-10 -85.32 -41.83 15.15 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -46.07 89.93 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.5 mt-30 -66.24 -34.21 77.49 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -73.52 -27.96 61.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.409 ' HG3' ' HA2' ' B' ' 47' ' ' GLY . 3.0 ttt -81.22 -24.22 37.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.757 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -81.82 -23.91 36.21 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 110.36 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 20.0 mmm -94.0 -18.44 21.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.244 -0.91 . . . . 0.0 110.484 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.6 p -92.99 -23.37 18.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.653 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -71.13 -9.66 58.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.229 -0.919 . . . . 0.0 110.625 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -65.8 -45.86 80.82 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.172 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.08 113.63 0.72 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -91.39 82.05 5.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.372 -1.075 . . . . 0.0 110.267 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -92.58 -27.89 17.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.396 -0.815 . . . . 0.0 110.112 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -94.35 17.84 12.17 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.0 110.427 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.52 83.17 0.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -104.29 81.65 1.85 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.379 -1.071 . . . . 0.0 110.28 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -91.13 -34.86 14.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -155.86 -52.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.336 -0.853 . . . . 0.0 110.252 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -147.59 136.63 22.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.375 -0.828 . . . . 0.0 110.254 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.158 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 17' ' ' VAL . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.598 HG22 HD23 ' B' ' 69' ' ' LEU . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.487 ' N ' HD22 ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.561 HD11 HG12 ' B' ' 30' ' ' ILE . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.401 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.459 ' O ' HD12 ' B' ' 56' ' ' LEU . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.847 HG23 HD12 ' B' ' 43' ' ' LEU . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.422 HG21 HD21 ' B' ' 56' ' ' LEU . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.561 HG12 HD11 ' B' ' 15' ' ' LEU . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HG3' HD22 ' B' ' 15' ' ' LEU . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.466 HG23 ' HD2' ' B' ' 37' ' ' PRO . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.466 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.426 ' CG ' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.488 ' O ' HD12 ' B' ' 69' ' ' LEU . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 23' ' ' ILE . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.435 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.482 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.409 ' HA2' ' HG3' ' A' ' 97' ' ' MET . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.848 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.454 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.459 HD12 ' O ' ' B' ' 18' ' ' GLU . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.848 ' CG ' HD22 ' B' ' 50' ' ' LEU . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.431 HD13 HD21 ' B' ' 67' ' ' LEU . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HG22 ' B' ' 7' ' ' THR . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.57 HG13 ' HB3' ' A' ' 92' ' ' GLN . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -93.22 131.8 37.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -112.34 157.52 20.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -122.12 156.06 34.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 110.141 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.83 156.38 43.53 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.337 -0.852 . . . . 0.0 110.248 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.2 -48.89 1.93 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 118.001 -1.444 . . . . 0.0 109.572 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.194 0.521 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttp -88.54 -177.06 5.51 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.384 -0.822 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.77 25.5 11.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.437 -0.79 . . . . 0.0 109.538 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 64.8 4.12 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mt -139.21 60.38 1.59 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.29 -1.124 . . . . 0.0 110.273 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.72 -128.38 0.1 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.01 -46.1 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.397 -1.061 . . . . 0.0 110.185 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.9 p -63.37 -27.37 69.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.35 -0.844 . . . . 0.0 110.175 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.1 -11.48 60.32 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.377 -0.827 . . . . 0.0 110.49 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HB3' HG21 ' A' ' 14' ' ' VAL . 63.9 m-85 -139.56 95.14 2.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.0 110.313 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -168.22 34.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.343 -0.848 . . . . 0.0 110.236 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.32 -44.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.455 -0.778 . . . . 0.0 110.077 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -106.75 29.01 11.47 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 10' ' ' PHE . 76.6 t -106.47 -62.26 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 0.0 110.062 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -168.18 163.34 8.83 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.351 -0.843 . . . . 0.0 110.137 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.4 -19.5 28.73 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 O-C-N 123.772 1.406 . . . . 0.0 110.677 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -66.49 -13.9 61.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.336 -0.852 . . . . 0.0 110.512 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.27 62.47 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.251 -0.906 . . . . 0.0 110.48 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.88 118.7 0.61 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.267 -0.895 . . . . 0.0 109.902 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 22' ' ' LEU . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.74 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.514 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.92 -30.67 65.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.94 65.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.348 -0.845 . . . . 0.0 110.162 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -28.45 67.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.856 . . . . 0.0 110.173 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.62 21.16 10.17 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.458 -0.776 . . . . 0.0 110.22 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.444 ' C ' HG23 ' A' ' 54' ' ' ILE . . . -127.35 -56.28 0.13 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.481 ' O ' HD12 ' A' ' 54' ' ' ILE . 1.1 pp -148.39 80.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.274 -1.133 . . . . 0.0 110.273 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -98.5 121.41 40.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.29 -0.881 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -77.31 89.78 3.74 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.411 -0.805 . . . . 0.0 110.131 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.4 m -77.62 97.46 5.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.21 -116.51 1.52 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.633 HG23 ' O ' ' A' ' 59' ' ' THR . 5.5 t -165.88 102.86 0.67 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.381 -1.07 . . . . 0.0 110.224 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -118.39 90.43 3.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.316 -0.865 . . . . 0.0 110.131 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -80.95 -42.49 21.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.383 -0.823 . . . . 0.0 110.262 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 17.0 m -122.96 81.63 1.89 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.363 -0.836 . . . . 0.0 110.261 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.31 -31.62 71.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.305 -0.872 . . . . 0.0 110.111 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -97.46 -27.47 14.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -112.81 -22.22 10.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.591 ' CE1' HG21 ' A' ' 79' ' ' THR . 51.0 t80 52.91 58.32 5.46 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.209 -0.932 . . . . 0.0 110.436 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -86.68 -54.61 2.61 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.34 117.5 32.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -1.083 . . . . 0.0 110.155 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 76' ' ' PHE . 3.0 m -153.38 31.69 0.47 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.422 -0.799 . . . . 0.0 110.313 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.66 36.1 4.22 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.08 153.06 1.54 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.411 -1.052 . . . . 0.0 108.909 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -76.71 38.45 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.539 1.284 . . . . 0.0 110.965 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.7 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.057 -1.027 . . . . 0.0 110.655 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -86.1 -29.91 22.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.415 -0.803 . . . . 0.0 110.073 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -65.18 -15.88 62.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.295 -0.878 . . . . 0.0 110.359 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.2 m -90.68 -22.87 20.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.7 mtt -88.47 123.93 33.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.828 . . . . 0.0 110.071 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.5 p -78.29 -164.49 0.56 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.36 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.6 pt-20 -67.25 -31.3 71.55 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.439 -0.788 . . . . 0.0 109.393 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.525 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.6 mt-10 -85.47 -40.22 16.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 2.7 tp10 -63.39 -45.08 92.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' B' ' 70' ' ' VAL . 36.7 mt-30 -67.28 -34.52 77.57 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.72 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB2' ' CG2' ' B' ' 70' ' ' VAL . . . -77.62 -36.91 51.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 ttm -76.35 -23.52 54.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.529 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -79.84 -26.17 40.53 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.495 -0.753 . . . . 0.0 110.034 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.1 ttp -96.09 -8.03 34.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.371 -0.831 . . . . 0.0 110.435 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.466 ' HB2' ' CD2' ' B' ' 68' ' ' HIS . 1.3 t -100.01 -21.85 15.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.254 -0.904 . . . . 0.0 110.433 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -19.46 45.99 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.254 -0.904 . . . . 0.0 110.14 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -98.91 51.02 0.96 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.235 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.22 -109.36 0.01 OUTLIER Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.78 84.47 6.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.383 -1.069 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.6 -74.71 0.2 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -168.97 -58.43 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.23 -32.15 2.6 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -100.68 65.23 1.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.43 -1.041 . . . . 0.0 110.251 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.26 70.14 0.1 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.39 -0.818 . . . . 0.0 110.226 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 53.03 30.83 10.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.304 -0.872 . . . . 0.0 110.482 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.1 t -107.5 -36.11 6.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.414 -0.804 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.192 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 12' ' ' THR . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.72 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 6' ' ' LYS . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.401 HD11 HG12 ' B' ' 30' ' ' ILE . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.455 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.526 HD13 HD13 ' B' ' 69' ' ' LEU . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.484 HG23 ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 24.3 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.426 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.401 ' N ' ' HB3' ' A' ' 100' ' ' SER . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.459 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 61' ' ' ILE . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.533 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' B' ' 56' ' ' LEU . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.466 ' CD2' ' HB2' ' A' ' 100' ' ' SER . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.526 HD13 HD13 ' B' ' 30' ' ' ILE . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 92' ' ' GLN . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -94.05 127.84 40.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -110.77 105.28 14.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.49 137.14 41.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.368 -0.832 . . . . 0.0 110.241 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -77.28 75.47 3.84 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.819 . . . . 0.0 110.072 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 71.77 -71.4 0.9 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.533 -179.956 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 t60 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.243 0.544 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 52.91 -174.95 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.32 -0.862 . . . . 0.0 110.389 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 3' ' ' LEU . 5.7 mp -112.69 25.85 11.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.335 -0.853 . . . . 0.0 109.618 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.0 -35.07 25.32 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.2 79.2 0.7 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.385 -1.068 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -124.91 41.14 1.75 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.29 -43.73 15.71 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -1.047 . . . . 0.0 110.177 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.4 t -61.64 -27.68 68.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.345 -0.847 . . . . 0.0 110.143 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.04 -28.26 66.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.335 -0.853 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -152.12 78.01 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.798 . . . . 0.0 110.175 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.77 113.9 20.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.381 -0.824 . . . . 0.0 110.386 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 51.92 29.25 5.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.324 -0.86 . . . . 0.0 110.501 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -119.63 25.8 7.51 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG23 ' OD2' ' A' ' 15' ' ' ASP . 28.9 m -118.76 -20.78 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.288 -1.125 . . . . 0.0 110.525 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.47 ' OD2' HG23 ' A' ' 14' ' ' VAL . 33.1 m-20 -125.39 150.43 67.54 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.227 -0.921 . . . . 0.0 110.188 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.65 -20.75 26.31 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.653 1.344 . . . . 0.0 110.744 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 25.7 p -70.48 -5.06 25.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.285 -0.884 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.59 19.23 4.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -169.66 121.11 0.6 Allowed Pre-proline 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 0.0 109.835 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.703 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 24' ' ' LEU . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.413 ' OE2' HG12 ' A' ' 28' ' ' VAL . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ARG . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.73 -34.0 71.44 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.69 16.22 24.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.478 -0.763 . . . . 0.0 110.319 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.14 -62.44 1.59 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.925 . . . . 0.0 110.07 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.46 22.06 15.51 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.426 -0.796 . . . . 0.0 110.156 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.59 -29.68 6.16 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.7 pt -72.28 63.99 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.376 -1.073 . . . . 0.0 110.175 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -165.6 113.63 0.97 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.408 -0.808 . . . . 0.0 110.139 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.402 ' C ' HG23 ' A' ' 57' ' ' THR . 6.3 t -117.13 -170.29 1.81 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.393 -0.817 . . . . 0.0 110.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.402 HG23 ' C ' ' A' ' 56' ' ' THR . 31.4 p -148.83 169.58 20.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.301 -0.874 . . . . 0.0 110.167 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -167.1 33.83 0.21 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.8 m -104.58 79.39 1.55 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.369 -1.077 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -99.58 66.43 1.44 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.91 -35.13 14.2 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -108.2 73.1 0.87 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.381 -0.824 . . . . 0.0 110.111 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.08 -40.05 68.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.318 -0.864 . . . . 0.0 110.414 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 71' ' ' ILE . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.48 ' N ' HG23 ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.24 -40.88 16.13 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -75.45 -42.32 53.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -104.05 94.41 5.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.41 -0.806 . . . . 0.0 110.213 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.37 86.27 0.08 OUTLIER Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 52.74 95.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.387 -1.066 . . . . 0.0 110.471 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -123.44 29.43 6.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.359 -0.838 . . . . 0.0 110.193 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.421 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -97.79 31.5 7.81 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.2 OUTLIER -163.9 149.77 9.45 Favored Pre-proline 0 N--CA 1.486 1.345 0 O-C-N 121.54 -0.976 . . . . 0.0 108.689 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -76.93 38.45 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.806 0 O-C-N 123.511 1.269 . . . . 0.0 110.912 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.06 44.96 28.41 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.629 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.664 HD21 HD13 ' B' ' 8' ' ' LEU . 3.9 mt -62.44 -49.99 73.26 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.31 -0.869 . . . . 0.0 110.098 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.7 m -71.88 -11.87 61.0 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.341 -0.85 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.1 t -102.04 -18.88 15.41 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.245 -0.909 . . . . 0.0 109.944 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 13.3 mtm -81.42 -162.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.404 -0.81 . . . . 0.0 109.845 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -144.49 -173.54 4.07 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.874 . . . . 0.0 110.344 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.567 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -64.71 -33.1 75.15 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.516 -0.74 . . . . 0.0 109.323 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.468 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 mt-10 -85.29 -41.74 15.26 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.556 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.58 -44.89 92.74 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.721 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.7 mt-30 -67.42 -34.12 76.57 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 178.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.77 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -79.04 -37.56 38.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.475 ' O ' HD12 ' A' ' 101' ' ' LEU . 37.0 mtt -80.32 -21.26 42.72 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.786 . . . . 0.0 109.92 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -80.6 -39.26 27.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.325 -0.86 . . . . 0.0 110.276 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 28.3 mmm -83.91 -26.76 29.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.382 -0.824 . . . . 0.0 110.408 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -77.14 -33.91 56.64 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.259 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 97' ' ' MET . 28.2 mt -63.77 -21.23 66.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.291 -0.88 . . . . 0.0 110.34 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.92 50.87 0.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.346 -0.846 . . . . 0.0 110.165 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -110.66 69.49 0.21 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.73 99.44 0.89 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.358 -1.084 . . . . 0.0 110.229 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -104.35 -64.94 1.06 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.449 -0.782 . . . . 0.0 110.248 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.27 87.63 1.4 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.281 -0.887 . . . . 0.0 110.193 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -102.42 -34.94 4.0 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.11 53.77 2.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.331 -1.099 . . . . 0.0 110.154 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.19 -47.55 8.77 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.328 -0.858 . . . . 0.0 110.14 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -121.1 -52.13 2.09 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.372 -0.83 . . . . 0.0 110.086 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 79.7 p -88.88 138.41 31.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.28 -0.887 . . . . 0.0 110.278 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.178 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.459 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' B' ' 12' ' ' THR . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.664 HD13 HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.562 HD11 HG12 ' B' ' 30' ' ' ILE . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.573 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.423 HG13 ' HB3' ' B' ' 50' ' ' LEU . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CD ' HG12 ' B' ' 17' ' ' VAL . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.562 HG12 HD11 ' B' ' 15' ' ' LEU . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.489 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.908 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.77 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.908 HD12 ' HB3' ' B' ' 43' ' ' LEU . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.41 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' B' ' 61' ' ' ILE . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.71 ' CD2' HD22 ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 92' ' ' GLN . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.76 120.27 34.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.422 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 0.3 OUTLIER -91.24 70.71 6.17 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.08 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.45 119.49 13.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.34 -0.85 . . . . 0.0 110.247 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.14 150.2 29.79 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.287 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 74.83 -93.35 0.84 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.022 -1.432 . . . . 0.0 109.547 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.219 0.533 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.26 -178.5 3.67 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.313 -0.867 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 3' ' ' LEU . 1.5 mm? -111.88 24.23 12.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.496 -0.753 . . . . 0.0 109.577 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.35 -48.02 4.16 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 tt -167.28 104.13 0.53 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.339 -1.095 . . . . 0.0 110.176 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.76 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.73 51.45 0.99 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.345 -1.091 . . . . 0.0 110.293 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 m -154.98 26.41 0.43 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.419 -0.801 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -111.83 -11.53 13.92 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -166.95 37.24 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.275 -0.89 . . . . 0.0 110.348 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -79.07 60.01 2.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.38 -0.825 . . . . 0.0 110.251 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -169.44 -57.46 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.338 -0.851 . . . . 0.0 110.209 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -109.88 49.2 0.87 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 p -117.43 -24.63 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.404 -1.056 . . . . 0.0 110.402 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -138.91 148.78 59.31 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.07 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.82 -15.41 29.83 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.696 1.367 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 54.0 p -72.9 -6.81 47.63 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.146 -0.971 . . . . 0.0 110.66 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.65 17.51 16.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.026 -1.046 . . . . 0.0 110.409 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.67 119.96 0.58 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.794 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.79 -21.98 65.06 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.71 -12.29 61.25 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.897 . . . . 0.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.38 -51.06 66.01 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.48 22.8 11.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 110.287 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -111.32 -67.27 0.54 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 54' ' ' ILE . 2.6 tp -102.76 58.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.337 -1.096 . . . . 0.0 110.185 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -120.45 -36.27 3.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.356 -0.84 . . . . 0.0 110.15 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 p -120.04 127.98 53.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.356 -0.84 . . . . 0.0 110.169 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 63.2 m -117.74 90.77 3.4 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.65 40.38 0.25 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 m -111.03 58.8 0.61 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.407 -1.055 . . . . 0.0 110.182 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -110.65 81.72 1.48 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.327 -0.858 . . . . 0.0 110.19 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.51 -41.49 3.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -0.849 . . . . 0.0 110.175 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.6 m -124.79 87.21 2.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.382 -0.824 . . . . 0.0 110.174 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.36 -29.74 66.23 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.251 -0.905 . . . . 0.0 110.233 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -81.66 -48.47 11.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.29 -45.43 94.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.324 -0.86 . . . . 0.0 110.103 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -88.51 106.6 18.39 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.428 -0.795 . . . . 0.0 110.211 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.4 -60.39 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -97.8 118.9 35.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.403 -1.057 . . . . 0.0 110.216 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -153.36 45.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.395 -0.815 . . . . 0.0 110.24 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -91.07 60.89 3.02 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 pp -172.54 147.47 1.7 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.31 -1.112 . . . . 0.0 108.886 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.09 64.24 2.59 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.599 1.315 . . . . 0.0 110.286 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -52.88 99.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.415 -0.803 . . . . 0.0 110.416 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.509 ' CD2' HD22 ' B' ' 8' ' ' LEU . 1.9 mp -76.8 -35.03 57.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.167 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.8 m -62.03 -17.99 59.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.337 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -107.71 -22.45 12.48 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.271 -0.893 . . . . 0.0 110.156 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.4 mtp -63.36 -165.09 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.007 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.8 p -141.43 -175.11 4.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.322 -0.861 . . . . 0.0 110.45 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.546 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.7 pt-20 -66.07 -31.37 72.21 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.558 -0.714 . . . . 0.0 109.295 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.491 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 58.2 mt-10 -83.23 -42.0 17.73 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -63.32 -43.88 96.52 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.657 ' HB3' HG13 ' B' ' 70' ' ' VAL . 80.0 mt-30 -67.27 -34.14 76.78 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.545 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.66 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -65.42 -32.1 73.54 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 mtt -81.34 -24.04 37.36 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 109.948 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -80.43 -26.27 38.51 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.366 -0.834 . . . . 0.0 110.433 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -91.73 -21.76 20.55 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.387 -0.821 . . . . 0.0 110.495 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.8 p -87.12 -23.57 24.83 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.375 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 101' ' ' LEU . 12.1 tp -83.69 3.36 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.334 -0.853 . . . . 0.0 110.708 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -159.53 27.13 0.19 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.203 -0.936 . . . . 0.0 110.31 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -83.72 -48.82 5.09 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.54 69.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.365 -1.08 . . . . 0.0 110.166 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 52.88 86.24 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.374 -0.828 . . . . 0.0 110.386 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.89 44.63 1.0 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.862 . . . . 0.0 110.214 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.58 39.79 2.63 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -128.8 102.64 6.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -1.064 . . . . 0.0 110.15 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.9 -17.44 18.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.414 -0.804 . . . . 0.0 110.414 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -92.02 44.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.251 -0.906 . . . . 0.0 110.368 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 2.7 t -169.44 -62.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.383 -0.823 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.199 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.54 HD13 HG21 ' B' ' 17' ' ' VAL . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.556 HD11 ' OE2' ' B' ' 34' ' ' GLU . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.775 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.775 HD12 ' C ' ' B' ' 14' ' ' THR . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.54 HG21 HD13 ' B' ' 3' ' ' ILE . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.706 ' O ' HD12 ' B' ' 56' ' ' LEU . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.504 ' HB3' HD23 ' B' ' 15' ' ' LEU . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD13 ' B' ' 69' ' ' LEU . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' GLU . . . . . 0.556 ' OE2' HD11 ' B' ' 13' ' ' ILE . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HA ' ' HB3' ' B' ' 72' ' ' ARG . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.799 ' HB3' HD12 ' B' ' 50' ' ' LEU . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.623 ' HB2' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.406 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.706 HD12 ' O ' ' B' ' 18' ' ' GLU . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.509 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.707 ' N ' HD22 ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.486 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 92' ' ' GLN . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.26 128.0 40.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.421 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 29.0 ttt-85 -99.4 106.93 19.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -0.872 . . . . 0.0 110.168 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mt -112.62 123.07 49.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 110.175 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -61.42 125.12 22.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.355 -0.841 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.69 151.14 6.11 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.039 -1.423 . . . . 0.0 109.58 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.246 0.546 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.1 mtp -119.51 -176.56 3.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.334 -0.854 . . . . 0.0 110.251 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mt -110.43 23.39 14.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.503 -0.748 . . . . 0.0 109.483 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.01 88.58 0.79 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 pp -94.58 21.52 7.19 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.438 -1.037 . . . . 0.0 110.484 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.93 178.04 43.02 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.35 37.27 3.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.407 -1.055 . . . . 0.0 110.232 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.1 m -109.13 -26.5 10.1 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.325 -0.86 . . . . 0.0 110.289 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -31.48 70.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.267 -0.896 . . . . 0.0 110.134 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -88.1 -10.27 50.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.436 -0.79 . . . . 0.0 110.555 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -58.86 91.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.276 -0.89 . . . . 0.0 110.312 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 52.61 31.27 9.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.297 -0.877 . . . . 0.0 110.359 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.35 -20.53 44.79 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.51 HG23 ' N ' ' A' ' 15' ' ' ASP . 35.4 m -143.37 -41.1 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.138 -1.213 . . . . 0.0 110.677 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.51 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -146.75 166.14 17.4 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.675 -179.637 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.79 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.8 Cg_endo -57.64 77.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.378 0 O-C-N 123.9 1.474 . . . . 0.0 111.45 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.4 t 68.03 41.23 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.463 0.649 . . . . 0.0 109.927 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.464 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.32 31.81 0.18 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.149 0.5 . . . . 0.0 110.786 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -161.73 115.26 1.24 Allowed Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.317 -0.864 . . . . 0.0 110.26 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.79 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.77 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 24' ' ' LEU . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.692 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.692 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.587 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.587 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.416 ' O ' HG22 ' A' ' 54' ' ' ILE . . . -62.05 -40.52 96.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.89 -27.13 63.58 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.376 -0.827 . . . . 0.0 110.249 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -83.07 78.1 9.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.403 -0.811 . . . . 0.0 110.186 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.25 30.34 7.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.34 -0.85 . . . . 0.0 110.401 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.7 -59.23 1.08 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.416 HG22 ' O ' ' A' ' 49' ' ' ALA . 14.9 tt -115.95 -18.37 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.371 -1.076 . . . . 0.0 110.435 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.83 164.62 17.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.218 -0.927 . . . . 0.0 110.182 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 m -67.92 157.91 33.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.346 -0.846 . . . . 0.0 110.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -143.13 174.83 10.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.296 -0.877 . . . . 0.0 110.329 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.35 -90.23 0.08 OUTLIER Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 m -151.77 104.36 3.02 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.369 -1.077 . . . . 0.0 110.202 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.04 73.59 1.37 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 110.191 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.69 -66.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.378 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.37 71.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.275 -0.89 . . . . 0.0 110.194 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -72.7 -39.76 66.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.33 -0.856 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -81.84 -38.17 25.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -72.86 -52.03 16.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.363 -0.836 . . . . 0.0 110.251 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.22 116.73 4.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.29 -0.881 . . . . 0.0 110.389 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.28 72.88 0.1 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.77 88.17 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.351 -1.088 . . . . 0.0 110.23 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.35 43.39 0.68 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.434 -0.791 . . . . 0.0 110.158 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -105.8 40.0 2.65 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.43 147.44 1.74 Allowed Pre-proline 0 N--CA 1.488 1.445 0 O-C-N 121.421 -1.046 . . . . 0.0 109.0 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -71.97 62.6 3.23 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.591 1.311 . . . . 0.0 110.231 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.71 110.32 0.87 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.382 -0.824 . . . . 0.0 110.386 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mp -84.73 -41.58 16.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.309 -0.87 . . . . 0.0 110.275 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 72.2 m -60.02 -31.34 69.86 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.402 -0.811 . . . . 0.0 110.214 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.5 m -84.71 -29.64 25.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.392 -0.818 . . . . 0.0 110.148 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.414 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 4.4 mtt -79.56 118.5 21.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.395 -0.815 . . . . 0.0 110.063 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.8 p -79.52 -162.19 0.39 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 110.546 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.4 pt-20 -67.89 -32.45 72.95 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.424 -0.798 . . . . 0.0 109.215 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 mt-10 -82.87 -40.03 20.79 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.081 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.41 ' HB3' ' CA ' ' A' ' 87' ' ' MET . 6.8 tp10 -64.47 -44.64 90.42 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.671 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.2 mt-30 -67.28 -33.52 75.48 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.763 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.752 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -70.44 -39.32 74.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.514 ' HA ' ' HG ' ' A' ' 100' ' ' SER . 43.7 mtt -78.41 -16.0 58.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.415 -0.803 . . . . 0.0 109.963 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -79.97 -41.45 25.93 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.378 -0.826 . . . . 0.0 110.469 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 86.4 mtp -85.06 -23.29 28.62 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.311 -0.868 . . . . 0.0 110.593 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.514 ' HG ' ' HA ' ' A' ' 97' ' ' MET . 85.4 p -83.83 -25.17 30.56 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.32 -0.863 . . . . 0.0 110.269 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.764 HD13 ' HA3' ' B' ' 47' ' ' GLY . 13.5 tp -90.04 11.52 20.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.33 30.0 1.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.207 -0.933 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -96.61 -94.36 1.84 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.47 79.67 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.357 -1.084 . . . . 0.0 110.31 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -89.85 82.74 6.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -120.57 -65.66 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.353 -0.842 . . . . 0.0 110.206 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.76 148.62 12.93 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.45 62.68 0.78 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -1.082 . . . . 0.0 110.2 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.52 44.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.311 -0.868 . . . . 0.0 110.174 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -111.23 -50.31 2.95 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.352 -0.843 . . . . 0.0 110.265 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.9 p -162.29 56.19 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.146 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.48 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.413 HG22 ' CD2' ' B' ' 69' ' ' LEU . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.763 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 30' ' ' ILE . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.586 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.534 ' O ' HD12 ' B' ' 56' ' ' LEU . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.586 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.427 HG12 HD11 ' B' ' 15' ' ' LEU . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.49 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.791 ' C ' HD12 ' B' ' 44' ' ' ILE . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.546 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.764 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.69 HD22 ' CG ' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.435 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' B' ' 61' ' ' ILE . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.69 ' CG ' HD22 ' B' ' 50' ' ' LEU . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.546 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.671 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt -94.15 111.64 23.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.45 67.04 5.09 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.86 158.64 32.12 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.407 -0.808 . . . . 0.0 110.216 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 141.68 32.88 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.343 -0.848 . . . . 0.0 110.171 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 65.53 147.6 0.06 OUTLIER Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.421 0 CA-C-O 118.018 -1.434 . . . . 0.0 109.525 -179.999 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -118.5 165.98 13.25 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.257 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.22 23.38 14.13 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.352 -0.842 . . . . 0.0 109.613 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.8 -63.42 2.72 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -149.53 22.18 0.92 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.567 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -129.45 -103.02 1.05 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.567 ' HB3' ' O ' ' A' ' 6' ' ' GLY . . . 65.22 -68.21 0.12 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.591 -0.946 . . . . 0.0 110.495 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 6' ' ' GLY . 0.4 OUTLIER -93.53 21.44 6.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 110.379 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.37 17.8 21.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.364 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -134.87 56.25 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 15' ' ' ASP . 3.6 tt0 -97.4 126.08 42.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.381 -0.824 . . . . 0.0 109.973 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.525 ' CG ' HD23 ' A' ' 22' ' ' LEU . 77.5 m-85 53.67 53.21 11.8 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.357 -0.839 . . . . 0.0 109.95 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.495 ' C ' HG13 ' A' ' 14' ' ' VAL . . . 96.89 -50.21 1.53 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.559 HG23 ' N ' ' A' ' 15' ' ' ASP . 26.9 m -151.64 -44.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -1.071 . . . . 0.0 110.342 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.559 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.4 OUTLIER 175.85 165.33 0.42 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.33 -0.856 . . . . 0.0 109.622 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.76 -23.65 22.35 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 O-C-N 123.571 1.301 . . . . 0.0 110.687 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.26 0.49 14.03 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.187 -0.945 . . . . 0.0 110.969 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.62 5.94 49.71 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.997 -1.064 . . . . 0.0 110.419 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -169.35 118.3 0.57 Allowed Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.126 -0.984 . . . . 0.0 110.118 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD23 ' CG ' ' A' ' 12' ' ' PHE . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 26' ' ' LEU . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -62.25 -35.53 79.23 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.4 -25.74 66.15 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.34 -0.85 . . . . 0.0 110.238 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -76.52 68.13 2.79 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.313 -0.867 . . . . 0.0 110.146 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.29 33.52 15.76 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.312 -0.867 . . . . 0.0 110.32 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -112.84 -36.0 1.6 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.2 tp -59.78 -32.54 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.315 -1.109 . . . . 0.0 110.175 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.86 118.06 22.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.399 -0.813 . . . . 0.0 110.133 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 56' ' ' THR . 8.2 t -144.6 132.05 20.88 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.415 -0.803 . . . . 0.0 110.227 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.1 t -155.37 33.46 0.37 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.345 -0.847 . . . . 0.0 110.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.3 30.35 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 m -100.59 67.37 1.29 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.388 -1.066 . . . . 0.0 110.119 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.87 75.84 7.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.0 110.228 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.9 -28.1 68.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.52 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 53.6 m -132.09 88.23 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.099 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -58.75 -32.17 69.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.253 -0.905 . . . . 0.0 110.313 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.959 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.959 ' N ' HD13 ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -82.44 -14.23 55.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 71' ' ' ILE . 12.4 tt0 -95.61 -30.75 13.62 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.255 -0.903 . . . . 0.0 110.178 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 72' ' ' SER . 26.6 t80 -59.19 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.318 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.08 -59.23 0.03 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -122.11 115.81 23.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -1.058 . . . . 0.0 110.006 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -121.98 27.78 7.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.0 110.237 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -95.96 18.8 56.77 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -174.79 152.87 1.63 Allowed Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.269 -1.136 . . . . 0.0 108.916 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.21 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.812 0 O-C-N 123.587 1.309 . . . . 0.0 110.845 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.555 ' N ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER 51.3 70.96 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.048 -1.032 . . . . 0.0 110.66 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 70.2 mt -75.01 -35.95 61.95 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -74.69 -3.39 31.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.405 -0.809 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -106.79 -9.89 16.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.064 -1.022 . . . . 0.0 110.085 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.437 ' HB2' ' CB ' ' A' ' 91' ' ' GLU . 15.2 ptp -106.61 141.28 38.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 63.0 p -86.08 -173.61 4.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.582 -0.699 . . . . 0.0 111.117 -178.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 4.9 pt-20 -62.02 -30.82 71.22 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.652 -0.655 . . . . 0.0 109.486 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 mt-10 -77.95 -42.41 33.04 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 87' ' ' MET . 5.4 mm-40 -63.0 -43.92 97.45 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 4.7 mm-40 -67.27 -36.0 80.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.582 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 98' ' ' GLN . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.811 ' CD2' HD13 ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.709 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -68.78 -40.13 79.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.0 mtt -78.62 -18.58 54.3 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.51 -0.744 . . . . 0.0 109.941 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -81.1 -29.84 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.223 -0.923 . . . . 0.0 110.354 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 11.3 mmm -100.31 -14.94 18.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.314 -0.867 . . . . 0.0 110.614 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 65.3 p -98.74 -29.05 13.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.3 tp -99.84 27.62 5.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.281 -0.887 . . . . 0.0 110.233 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -132.03 26.69 4.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.809 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.97 47.93 0.87 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.81 68.07 8.03 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.4 -1.059 . . . . 0.0 110.194 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.27 78.19 0.5 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.324 -0.86 . . . . 0.0 110.208 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' PHE . . . . . 0.499 ' N ' ' CD1' ' A' ' 106' ' ' PHE . 23.7 p90 -142.6 54.02 1.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.333 -0.854 . . . . 0.0 110.223 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.49 36.73 2.39 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.6 74.31 1.87 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.311 -1.111 . . . . 0.0 110.359 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.13 39.55 1.28 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.288 -0.883 . . . . 0.0 110.035 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.29 49.13 0.84 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.0 t -95.1 -35.97 11.69 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.356 -0.84 . . . . 0.0 110.14 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.235 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.518 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.577 HD12 HD22 ' B' ' 67' ' ' LEU . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.532 HD11 HG12 ' B' ' 30' ' ' ILE . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.598 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.544 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.42 ' CE ' HG22 ' B' ' 23' ' ' ILE . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.598 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.532 HG12 HD11 ' B' ' 15' ' ' LEU . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.487 ' C ' HD22 ' B' ' 43' ' ' LEU . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.487 HD22 ' C ' ' B' ' 42' ' ' ARG . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.709 HG21 ' HB1' ' A' ' 96' ' ' ALA . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.787 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.481 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.62 ' HA ' HD12 ' B' ' 61' ' ' ILE . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.787 ' CG ' HD22 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 3' ' ' ILE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.607 HG13 ' HB3' ' A' ' 92' ' ' GLN . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 7.8 mt -94.08 122.14 36.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -104.67 111.6 24.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.317 -0.865 . . . . 0.0 110.111 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 mt -93.36 175.46 6.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.371 -0.831 . . . . 0.0 110.275 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -108.21 36.63 2.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.63 149.37 19.86 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 CA-C-O 118.055 -1.414 . . . . 0.0 109.58 179.994 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.1 mtm -78.97 176.1 9.95 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.415 -0.803 . . . . 0.0 110.225 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.11 26.23 10.91 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 109.269 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.35 -110.94 3.27 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.5 mt 51.77 48.3 23.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.398 -1.06 . . . . 0.0 110.466 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -141.33 -153.56 5.98 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.46 49.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.331 -1.099 . . . . 0.0 110.245 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.0 m -116.73 -22.92 8.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.435 -0.791 . . . . 0.0 110.544 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -35.41 74.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -0.903 . . . . 0.0 110.31 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.488 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 13.5 p90 -148.05 59.49 1.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.301 -0.875 . . . . 0.0 110.37 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.3 75.32 0.24 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.456 -0.777 . . . . 0.0 110.247 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 51.9 62.63 2.6 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.361 -0.837 . . . . 0.0 110.59 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.98 28.17 0.73 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -116.71 -25.64 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -1.112 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -75.88 -179.82 1.24 Allowed Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 -179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.836 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.9 Cg_endo -60.86 78.37 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.278 0 O-C-N 123.69 1.363 . . . . 0.0 110.867 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 m 68.95 46.27 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 42.45 30.39 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.993 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -165.2 115.17 0.86 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.253 -0.905 . . . . 0.0 110.592 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.836 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' A' ' 26' ' ' LEU . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 24' ' ' LEU . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG2' ' HA ' ' A' ' 29' ' ' SER . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.689 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.689 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -62.14 -28.4 69.62 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.19 -16.08 41.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.389 -0.82 . . . . 0.0 110.436 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -91.19 -57.11 2.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.181 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.58 25.93 4.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.822 . . . . 0.0 110.163 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -108.52 -45.12 1.08 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.537 HG23 ' O ' ' A' ' 54' ' ' ILE . 1.3 tp -113.23 66.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -1.124 . . . . 0.0 110.237 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.1 -4.32 10.57 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.585 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 56' ' ' THR . 7.8 t -103.73 66.65 0.86 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.176 -0.952 . . . . 0.0 110.347 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.4 m -73.79 -56.24 5.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.322 -0.861 . . . . 0.0 110.176 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -160.55 52.81 0.35 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -87.38 54.01 3.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.352 -1.087 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -111.29 63.61 0.61 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.846 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.68 -37.3 42.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.304 -0.873 . . . . 0.0 110.191 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 p -96.7 69.45 2.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.297 -0.877 . . . . 0.0 110.251 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -69.77 0.42 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.333 -0.854 . . . . 0.0 110.107 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 71' ' ' ILE . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -80.09 -40.86 26.71 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.83 -36.13 75.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.39 -0.819 . . . . 0.0 109.997 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -73.13 -32.72 65.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.403 -0.811 . . . . 0.0 110.137 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.32 80.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -96.65 115.28 27.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -1.076 . . . . 0.0 110.058 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -122.5 3.32 9.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.295 -0.878 . . . . 0.0 110.609 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.47 -17.01 59.27 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -169.84 149.54 3.53 Favored Pre-proline 0 N--CA 1.487 1.411 0 O-C-N 121.217 -1.167 . . . . 0.0 108.85 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -76.09 40.38 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 123.516 1.271 . . . . 0.0 110.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.5 75.82 0.17 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.05 -1.031 . . . . 0.0 110.552 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -72.69 -33.07 66.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.281 -0.887 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.1 m -62.63 -23.34 67.02 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.276 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.8 t -80.5 -29.13 37.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.899 . . . . 0.0 110.033 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.409 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 33.7 mtm -87.67 119.42 27.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.361 -0.837 . . . . 0.0 109.826 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.7 p -79.62 -164.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.797 . . . . 0.0 110.51 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.542 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.7 pt-20 -66.29 -31.89 72.97 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.469 -0.769 . . . . 0.0 109.363 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.488 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.2 mt-10 -85.17 -40.39 16.77 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.73 -44.84 92.36 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 47.7 mt-30 -67.89 -34.19 76.17 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.542 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.649 ' CD2' HD13 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -67.93 -32.51 73.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.4 ' O ' HD12 ' A' ' 101' ' ' LEU . 41.6 mtp -76.86 -21.55 54.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.69 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -83.49 -22.49 32.51 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.466 -0.771 . . . . 0.0 110.424 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 24.9 mmt -89.72 -26.94 20.39 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.341 -0.85 . . . . 0.0 110.412 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.29 -25.0 23.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.418 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.4 HD12 ' O ' ' A' ' 97' ' ' MET . 30.3 mt -82.6 3.23 29.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.341 -0.85 . . . . 0.0 110.639 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -141.43 50.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.13 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.14 -55.95 0.07 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.07 74.12 10.3 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -1.116 . . . . 0.0 110.196 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -153.09 28.48 0.51 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.39 -0.819 . . . . 0.0 110.184 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.06 75.11 1.63 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.362 -0.836 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -103.36 36.59 4.23 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -105.78 54.54 0.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.394 -1.062 . . . . 0.0 110.178 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.77 88.76 2.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.362 -0.836 . . . . 0.0 110.083 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -95.87 35.46 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.366 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.0 t -71.6 174.96 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.356 -0.84 . . . . 0.0 110.129 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.219 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.445 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.494 HD13 HG21 ' B' ' 17' ' ' VAL . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.7 ' CE1' HG23 ' B' ' 14' ' ' THR . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.649 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 13' ' ' ILE . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.7 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.494 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.668 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.632 HG23 HD12 ' B' ' 43' ' ' LEU . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.498 HG23 ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.498 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.427 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.632 HD12 HG23 ' B' ' 23' ' ' ILE . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.646 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.429 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.668 HD12 ' O ' ' B' ' 18' ' ' GLU . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.646 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.429 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.523 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.652 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.652 ' N ' HD23 ' B' ' 69' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.23 115.1 27.31 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.95 115.51 27.53 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.47 165.29 12.62 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.41 -0.806 . . . . 0.0 110.168 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -113.4 137.85 50.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.343 -0.848 . . . . 0.0 110.212 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.5 -90.83 1.03 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.42 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.945 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.162 0.506 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.657 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -155.16 -55.33 0.09 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.346 -0.846 . . . . 0.0 110.24 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.657 HD12 ' O ' ' A' ' 2' ' ' MET . 0.6 OUTLIER 76.83 35.97 0.36 Allowed 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.013 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.95 -105.46 0.04 OUTLIER Glycine 0 N--CA 1.481 1.639 0 N-CA-C 109.794 -1.323 . . . . 0.0 109.794 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.43 77.01 1.25 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.35 -1.088 . . . . 0.0 110.065 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -88.9 -103.57 1.02 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.28 -39.76 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.424 -1.045 . . . . 0.0 110.312 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 35.3 t -54.1 -28.83 41.82 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.271 -0.893 . . . . 0.0 110.285 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -35.76 80.7 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' A' ' 14' ' ' VAL . 1.3 m-85 -112.81 94.57 4.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.345 -0.847 . . . . 0.0 110.03 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.615 ' O ' ' HB3' ' A' ' 12' ' ' PHE . 30.6 tt0 -140.45 127.62 20.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.428 -0.795 . . . . 0.0 109.694 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.615 ' HB3' ' O ' ' A' ' 11' ' ' GLU . 45.1 t80 66.55 -55.68 0.41 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.806 -0.559 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLU . . . -51.85 -26.04 17.26 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 10' ' ' PHE . 84.2 t -94.78 -66.17 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.193 -1.181 . . . . 0.0 110.097 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.43 168.47 9.08 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.52 -19.24 28.63 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.713 1.375 . . . . 0.0 110.718 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.62 -10.31 57.71 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 0.0 110.621 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.33 -15.43 63.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.194 -0.941 . . . . 0.0 110.534 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.49 120.47 0.6 Allowed Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.24 -0.912 . . . . 0.0 109.852 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.421 ' HA ' HD12 ' A' ' 26' ' ' LEU . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.02 -34.17 59.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.35 -18.73 59.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.377 -0.827 . . . . 0.0 110.25 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -107.95 -38.12 5.9 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.38 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.7 -18.4 12.77 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.418 -0.801 . . . . 0.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.81 -81.86 0.22 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.1 pt -93.85 68.33 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -1.125 . . . . 0.0 110.283 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.05 -32.12 15.3 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.426 -0.796 . . . . 0.0 110.159 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.1 p -87.03 120.03 27.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.322 -0.861 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.9 m -128.7 163.52 24.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 110.217 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.51 98.3 0.21 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -83.09 72.53 10.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.357 -1.084 . . . . 0.0 110.285 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -112.79 94.56 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.41 -0.806 . . . . 0.0 110.073 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -115.54 -36.75 4.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.463 -0.773 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.475 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 68.1 m -118.61 71.41 0.84 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.37 -0.831 . . . . 0.0 110.257 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -77.62 -60.36 2.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.293 -0.879 . . . . 0.0 110.265 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.475 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.971 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.971 ' N ' HD13 ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -86.62 -14.07 43.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' O ' ' A' ' 71' ' ' ILE . 38.0 tt0 -90.59 -41.51 11.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.173 -0.955 . . . . 0.0 110.139 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.04 -25.13 16.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.448 -0.783 . . . . 0.0 110.246 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -29.06 71.55 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.55 100.5 3.79 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.282 -1.128 . . . . 0.0 110.254 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.745 ' O ' HD12 ' A' ' 81' ' ' LEU . 91.7 m -92.87 -104.38 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.503 -0.748 . . . . 0.0 109.873 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.505 ' N ' HG22 ' A' ' 79' ' ' THR . . . 51.16 39.71 42.74 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 79' ' ' THR . 0.3 OUTLIER -157.99 140.41 10.43 Favored Pre-proline 0 C--N 1.305 -1.327 0 O-C-N 121.391 -1.064 . . . . 0.0 108.667 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -74.51 40.02 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 123.44 1.232 . . . . 0.0 110.678 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 49.76 83.2 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 110.497 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.542 HD11 HD12 ' B' ' 8' ' ' LEU . 0.7 OUTLIER -82.78 -38.99 22.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.45 -0.781 . . . . 0.0 110.339 -179.741 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.11 -12.01 60.12 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.407 -0.808 . . . . 0.0 110.691 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.3 -25.12 14.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 109.847 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.433 ' C ' HG23 ' A' ' 88' ' ' THR . 20.2 mtt -67.52 -162.32 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.46 -0.775 . . . . 0.0 109.822 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.433 HG23 ' C ' ' A' ' 87' ' ' MET . 77.4 p -148.55 -171.1 3.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.278 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.566 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -65.78 -32.91 74.72 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.47 -0.769 . . . . 0.0 109.246 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 4.3 mt-10 -85.26 -42.13 14.93 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.361 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -44.93 94.67 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.689 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 -67.27 -33.62 75.68 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.566 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.693 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.596 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -77.07 -32.99 57.15 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.444 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 9.4 mtt -83.07 -23.55 33.1 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.404 -0.81 . . . . 0.0 109.944 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -83.12 -35.88 25.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.38 -0.825 . . . . 0.0 110.34 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.1 -26.31 42.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.364 -0.835 . . . . 0.0 110.196 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.425 ' HB3' ' N ' ' B' ' 46' ' ' ALA . 62.4 m -80.97 -36.4 30.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.379 -0.826 . . . . 0.0 110.501 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.69 -14.7 59.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.308 -0.87 . . . . 0.0 110.495 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.11 35.77 1.69 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.915 . . . . 0.0 110.236 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.16 86.3 0.25 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.83 83.79 0.45 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.361 -1.082 . . . . 0.0 110.258 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -96.19 49.6 1.14 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.084 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -115.36 -43.5 3.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.456 -0.777 . . . . 0.0 110.135 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.53 77.15 0.39 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.52 86.63 2.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -1.102 . . . . 0.0 110.14 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.28 84.5 0.23 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.402 -0.811 . . . . 0.0 110.251 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 54.32 31.78 15.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.363 -0.836 . . . . 0.0 110.476 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.9 m -112.63 99.67 8.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.311 -0.868 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.2 -179.922 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.489 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.595 HD12 HD22 ' B' ' 67' ' ' LEU . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.693 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.769 ' C ' HD12 ' B' ' 15' ' ' LEU . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.769 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.489 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.606 HG23 HD12 ' B' ' 43' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.474 ' CD ' HG12 ' B' ' 17' ' ' VAL . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.452 HG23 ' HD2' ' B' ' 37' ' ' PRO . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.455 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.455 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.672 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.672 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' ALA . . . . . 0.425 ' N ' ' HB3' ' A' ' 100' ' ' SER . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.444 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.808 HD22 ' CD2' ' B' ' 59' ' ' TYR . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' B' ' 61' ' ' ILE . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.808 ' CD2' HD22 ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.432 HD12 ' HA ' ' B' ' 56' ' ' LEU . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.595 HD22 HD12 ' B' ' 3' ' ' ILE . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 92' ' ' GLN . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.26 116.62 29.03 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -107.08 130.57 54.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.448 -0.782 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 10.9 mt -71.13 179.22 2.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.336 -0.852 . . . . 0.0 110.24 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.61 158.77 35.6 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.361 -0.837 . . . . 0.0 110.194 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.75 61.18 0.16 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.579 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.261 0.553 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -166.6 2.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.072 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.83 24.5 12.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.445 -0.784 . . . . 0.0 109.569 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.17 68.89 3.26 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.92 -64.91 0.34 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.335 -1.097 . . . . 0.0 110.158 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.78 172.3 31.85 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.34 28.36 4.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -1.093 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.3 t -140.1 21.05 2.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.34 -0.85 . . . . 0.0 110.417 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 45.5 p-10 -91.42 -14.69 30.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.884 . . . . 0.0 110.379 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.406 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 19.8 m-85 -127.68 56.78 1.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.223 -0.923 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 57.53 4.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.278 -0.889 . . . . 0.0 110.398 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 6.7 m-85 51.28 40.55 26.5 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.347 -0.846 . . . . 0.0 110.531 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.436 ' C ' HG13 ' A' ' 14' ' ' VAL . . . -136.44 27.6 2.96 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.508 HG23 ' N ' ' A' ' 15' ' ' ASP . 35.8 m -148.68 -40.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -1.105 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.0 p30 -135.86 163.52 49.87 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.68 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 35.6 Cg_endo -57.99 73.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.836 1.44 . . . . 0.0 111.745 -178.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.7 m 63.26 34.17 13.55 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.51 0.671 . . . . 0.0 109.361 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 37.21 35.29 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.221 0.534 . . . . 0.0 111.226 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.62 120.88 0.6 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.42 -0.8 . . . . 0.0 109.801 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.715 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 24' ' ' LEU . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -28.58 61.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.2 -10.28 59.31 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.398 -0.814 . . . . 0.0 110.514 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -100.96 -36.15 9.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.155 -0.966 . . . . 0.0 110.254 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.54 -32.43 11.11 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.206 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.24 -58.73 3.84 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.564 ' O ' HG22 ' A' ' 54' ' ' ILE . 39.9 mm -83.87 68.74 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -1.095 . . . . 0.0 110.214 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -168.96 33.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.262 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.0 p -139.89 81.76 1.84 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.319 -0.863 . . . . 0.0 110.245 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 p -100.38 71.52 1.56 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.411 -0.805 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.17 31.13 0.31 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 m -129.63 101.11 5.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -1.105 . . . . 0.0 110.136 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -82.33 73.48 9.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.365 -0.834 . . . . 0.0 110.147 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.0 -58.62 5.1 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.397 -0.815 . . . . 0.0 110.285 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.492 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 70.5 m -133.04 96.66 3.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.318 -0.864 . . . . 0.0 110.295 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.89 -33.57 75.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.292 -0.88 . . . . 0.0 110.105 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.663 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -76.1 -39.9 54.2 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.07 -57.44 4.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.448 -0.783 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 50.98 76.39 0.16 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.372 -0.83 . . . . 0.0 110.344 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.05 -79.35 0.09 OUTLIER Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.464 ' NH2' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -73.7 107.99 6.27 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -1.122 . . . . 0.0 110.267 -179.809 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.3 m -153.29 25.33 0.53 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.358 -0.839 . . . . 0.0 110.218 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.523 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -97.41 21.93 43.5 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' C ' ' A' ' 80' ' ' GLY . 0.5 OUTLIER -159.98 144.68 11.02 Favored Pre-proline 0 N--CA 1.484 1.243 0 O-C-N 121.34 -1.094 . . . . 0.0 108.733 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.39 39.45 0.68 Allowed 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 123.495 1.26 . . . . 0.0 110.697 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 50.76 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 tp -60.93 -32.23 71.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 110.163 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 81.4 p -60.82 -23.75 65.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.359 -0.838 . . . . 0.0 110.298 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -80.99 -27.76 35.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.348 -0.845 . . . . 0.0 109.897 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.6 mtt -88.15 119.82 28.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.876 . . . . 0.0 109.935 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 67.6 p -78.38 -164.52 0.57 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 110.424 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.484 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.6 pt-20 -67.3 -31.26 71.44 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 0.0 109.259 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.9 mt-10 -85.42 -40.26 16.64 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -45.18 92.0 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.629 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.3 mt-30 -67.05 -33.86 76.43 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.752 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD2' HD13 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.738 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -82.4 -32.63 29.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -26.3 46.39 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.261 -0.899 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -80.15 -44.13 20.41 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.524 -0.735 . . . . 0.0 110.202 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 30.8 mtm -78.58 -10.24 59.66 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.441 -0.787 . . . . 0.0 110.566 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -97.78 -21.21 17.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.236 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.497 HD13 ' HA3' ' B' ' 47' ' ' GLY . 15.1 tp -91.51 16.45 10.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.401 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.88 -37.38 10.73 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.204 -0.935 . . . . 0.0 110.155 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -70.56 -34.33 67.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -99.57 88.57 3.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -1.097 . . . . 0.0 110.147 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -71.83 65.31 0.51 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -168.44 107.32 0.49 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -146.25 131.19 3.97 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -127.42 76.24 1.65 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.318 -1.107 . . . . 0.0 110.188 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.76 38.59 4.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.311 -0.868 . . . . 0.0 110.307 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 51.78 55.2 9.68 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.28 -0.888 . . . . 0.0 110.483 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -99.67 175.09 5.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.212 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.243 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.463 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.41 HD12 HD22 ' B' ' 67' ' ' LEU . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' B' ' 12' ' ' THR . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.589 ' HG2' HG23 ' B' ' 12' ' ' THR . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.492 HG22 HD23 ' B' ' 69' ' ' LEU . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.589 HG23 ' HG2' ' B' ' 6' ' ' LYS . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.481 HD11 HG12 ' B' ' 30' ' ' ILE . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.624 HG12 ' HD3' ' B' ' 29' ' ' LYS . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.696 HG23 HD12 ' B' ' 43' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.414 ' HE2' HG22 ' B' ' 23' ' ' ILE . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.624 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.481 HG12 HD11 ' B' ' 15' ' ' LEU . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.752 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.798 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.798 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.472 ' HB3' HD21 ' B' ' 50' ' ' LEU . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.497 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.649 HD22 ' CG ' ' B' ' 59' ' ' TYR . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.488 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.649 ' CG ' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.446 HD23 HD22 ' B' ' 43' ' ' LEU . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.492 HD23 HG22 ' B' ' 7' ' ' THR . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.629 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -93.93 126.4 39.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.03 102.08 11.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.353 -0.842 . . . . 0.0 110.045 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.14 171.33 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.302 -0.874 . . . . 0.0 110.187 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -119.73 170.83 8.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.385 -0.822 . . . . 0.0 110.329 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 158.98 79.47 0.03 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.547 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 m170 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.22 0.534 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.57 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -155.53 -52.21 0.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.111 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.57 ' CB ' ' O ' ' A' ' 2' ' ' MET . 3.8 tp 80.97 35.87 0.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.15 -85.82 0.37 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 52.46 34.65 15.75 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.368 -1.077 . . . . 0.0 110.444 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -93.22 112.49 4.29 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.46 29.6 3.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.357 -1.084 . . . . 0.0 110.24 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -116.39 -30.35 5.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.344 -0.847 . . . . 0.0 110.287 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.08 -38.37 76.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.284 -0.885 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.09 87.0 2.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.373 -0.829 . . . . 0.0 110.149 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -98.15 75.73 2.32 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -159.96 -44.34 0.05 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.175 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -113.07 30.37 7.42 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.487 HG23 ' N ' ' A' ' 15' ' ' ASP . 33.7 m -130.97 -39.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.445 -1.032 . . . . 0.0 110.295 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.487 ' N ' HG23 ' A' ' 14' ' ' VAL . 14.0 p-10 -125.08 142.93 42.66 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.414 -0.804 . . . . 0.0 110.241 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 -28.56 17.91 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.566 1.298 . . . . 0.0 110.377 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -61.1 -23.39 65.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.72 -21.64 55.59 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.187 -0.946 . . . . 0.0 110.418 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.53 120.31 0.6 Allowed Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 24' ' ' LEU . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.05 -32.96 39.39 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.3 -12.7 56.38 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.31 -0.869 . . . . 0.0 110.535 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.55 -50.24 10.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.275 -0.891 . . . . 0.0 110.26 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.63 32.01 6.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.307 -0.871 . . . . 0.0 110.3 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -116.39 -34.26 1.34 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.2 tt -97.6 -19.42 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.393 -1.063 . . . . 0.0 110.413 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.38 118.62 10.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.223 -0.923 . . . . 0.0 110.272 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.8 t -63.01 155.61 27.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.374 -0.829 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.7 m -98.15 128.43 44.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.3 -0.875 . . . . 0.0 110.169 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -138.91 -98.37 0.42 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 59' ' ' THR . 6.4 t -160.7 66.41 0.32 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.393 -1.063 . . . . 0.0 110.204 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' O ' ' N ' ' A' ' 62' ' ' SER . 7.1 mt-10 -143.79 43.43 1.47 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.444 -0.785 . . . . 0.0 110.46 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.648 ' O ' ' N ' ' A' ' 63' ' ' ASP . 23.2 m-20 -55.67 97.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.766 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -51.09 76.81 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.598 0.713 . . . . 0.0 110.807 -177.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.648 ' N ' ' O ' ' A' ' 61' ' ' ASP . 31.6 m-20 -73.66 -44.94 55.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.696 -0.627 . . . . 0.0 110.085 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.766 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 66' ' ' LEU . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.62 -51.08 5.71 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.6 tm-20 -71.15 -10.23 59.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.351 -0.843 . . . . 0.0 110.559 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.74 99.57 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.201 -0.937 . . . . 0.0 110.542 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.63 -59.73 0.51 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -85.06 115.77 23.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -1.068 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.0 m -144.95 44.37 1.35 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.443 -0.786 . . . . 0.0 110.221 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.97 25.54 27.9 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.57 148.79 2.32 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.268 -1.137 . . . . 0.0 108.942 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.34 38.67 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 O-C-N 123.52 1.274 . . . . 0.0 110.737 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.79 92.5 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.114 -0.991 . . . . 0.0 110.476 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 41.2 mt -52.89 -30.24 32.99 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.323 -0.861 . . . . 0.0 110.472 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.21 -18.87 65.62 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.0 p -84.83 -28.38 26.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 110.142 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' MET . . . . . 0.408 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 30.4 mtt -76.29 118.16 18.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.35 -0.844 . . . . 0.0 110.088 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 79.4 p -79.87 -163.32 0.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.381 -0.825 . . . . 0.0 110.607 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 15.0 pt-20 -67.09 -32.11 73.05 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.526 -0.734 . . . . 0.0 109.303 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.6 mt-10 -85.17 -39.75 17.49 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 1.4 tp10 -63.9 -46.05 86.58 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.711 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 -65.96 -34.8 78.94 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 177.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.74 ' CD2' HD13 ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.792 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -78.77 -35.55 44.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.9 mtt -80.37 -22.79 40.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.404 -0.81 . . . . 0.0 109.917 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -80.96 -43.63 19.42 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.262 -0.899 . . . . 0.0 110.518 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -17.87 56.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.385 -0.822 . . . . 0.0 110.603 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.0 m -90.29 -23.79 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.95 . . . . 0.0 110.318 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.4 tp -87.71 10.87 16.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.221 -0.925 . . . . 0.0 110.475 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -94.44 -61.95 1.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.236 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 111.77 88.42 1.8 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -118.37 93.08 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.328 -1.101 . . . . 0.0 110.242 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.51 53.44 0.74 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.789 . . . . 0.0 110.141 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -117.71 -48.89 2.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.94 -121.54 7.28 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.13 87.1 4.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -1.121 . . . . 0.0 110.183 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.58 80.66 4.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.292 -0.88 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 52.29 55.54 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.36 -0.838 . . . . 0.0 110.446 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.23 -47.44 13.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.309 -0.87 . . . . 0.0 110.255 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.251 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.409 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 14' ' ' THR . . . . . 0.725 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.725 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 1' ' ' MET . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' VAL . . . . . 0.571 HG21 HD21 ' B' ' 56' ' ' LEU . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.604 HD13 HD12 ' B' ' 69' ' ' LEU . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.493 ' CZ ' HD11 ' A' ' 93' ' ' ILE . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.784 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.792 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 67' ' ' LEU . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.782 HD22 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.782 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.715 HD12 ' HA ' ' B' ' 56' ' ' LEU . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.621 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.711 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt -94.15 125.34 38.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 12.0 ttt180 -101.55 107.12 18.31 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -0.863 . . . . 0.0 110.275 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 mt -99.19 145.74 26.89 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.375 -0.828 . . . . 0.0 110.09 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -166.32 123.58 1.36 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.312 -0.867 . . . . 0.0 110.218 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.54 91.32 0.29 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 CA-C-O 117.977 -1.457 . . . . 0.0 109.558 179.943 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.312 0.577 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttm -74.52 -164.42 0.27 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.287 -0.883 . . . . 0.0 110.173 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mp -111.66 24.38 12.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.482 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.59 -121.32 0.67 Allowed Glycine 0 N--CA 1.487 2.073 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tp 52.53 34.54 15.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.302 -1.117 . . . . 0.0 110.418 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.78 163.81 20.56 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.02 -34.8 4.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -1.092 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -60.23 -30.13 69.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.66 -27.15 68.47 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 110.19 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.555 ' CD2' HG21 ' A' ' 14' ' ' VAL . 28.3 t80 -111.08 -20.52 12.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.429 -0.795 . . . . 0.0 110.252 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.422 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 24.2 tt0 -95.29 51.58 1.34 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 0.0 110.378 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -168.76 -52.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.21 -24.06 49.29 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.555 HG21 ' CD2' ' A' ' 10' ' ' PHE . 59.6 t -76.43 -67.24 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.274 -1.133 . . . . 0.0 110.32 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 17' ' ' SER . 30.0 p30 -116.87 161.75 30.79 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.275 -0.891 . . . . 0.0 110.063 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.426 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.2 Cg_endo -58.46 73.22 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.863 1.454 . . . . 0.0 111.767 -178.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.51 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 63.75 34.78 11.78 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.659 0.743 . . . . 0.0 109.277 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HG3' ' A' ' 11' ' ' GLU . . . 38.22 33.3 0.06 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.354 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.65 117.37 0.54 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.876 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.69 HD23 ' O ' ' A' ' 24' ' ' LEU . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 26' ' ' LEU . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 24' ' ' LEU . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -64.93 -27.87 69.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.849 ' O ' ' HB2' ' A' ' 55' ' ' ALA . . . -89.2 -19.83 24.94 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.376 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HA ' ' CB ' ' A' ' 55' ' ' ALA . 0.9 OUTLIER -103.8 28.22 6.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.852 . . . . 0.0 110.177 -179.927 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.9 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.146 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.97 -53.32 15.36 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.9 tp -111.69 -17.6 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.339 -1.095 . . . . 0.0 110.419 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.849 ' HB2' ' O ' ' A' ' 50' ' ' ALA . . . -68.88 -164.02 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.128 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 t -112.15 154.49 25.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.837 . . . . 0.0 110.206 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.5 m -79.58 93.14 5.41 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.412 -0.805 . . . . 0.0 110.29 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 59' ' ' THR . . . -151.2 -143.83 3.79 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 58' ' ' GLY . 16.0 p -153.51 97.61 2.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -1.113 . . . . 0.0 110.259 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -106.1 45.25 0.98 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.855 . . . . 0.0 110.218 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -130.51 -41.45 1.21 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.443 -0.786 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -118.13 79.54 1.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.375 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -56.19 -29.54 61.02 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.872 . . . . 0.0 110.212 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 71' ' ' ILE . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' LYS . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -110.51 -17.08 13.52 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 26.4 tt0 -107.26 -15.61 14.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.096 -1.003 . . . . 0.0 110.969 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CG ' ' O ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -84.18 43.07 0.92 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.082 -1.012 . . . . 0.0 111.094 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -84.32 0.1 OUTLIER Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.649 -1.381 . . . . 0.0 109.649 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -71.8 -35.48 69.98 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.419 -1.048 . . . . 0.0 110.308 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.656 HG22 ' O ' ' A' ' 79' ' ' THR . 88.9 m 52.56 25.15 3.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.393 -0.817 . . . . 0.0 110.158 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.46 ' O ' HD23 ' A' ' 81' ' ' LEU . . . 94.72 -89.0 1.18 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 80' ' ' GLY . 94.5 mt -152.26 146.26 18.29 Favored Pre-proline 0 C--N 1.305 -1.348 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -77.54 36.98 0.58 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 123.368 1.194 . . . . 0.0 110.807 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.43 62.16 2.83 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.218 -0.926 . . . . 0.0 110.62 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.606 HD21 HD22 ' B' ' 8' ' ' LEU . 8.5 mt -60.88 -36.38 79.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.34 -0.85 . . . . 0.0 110.184 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.6 p -74.44 -3.6 31.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.402 -0.811 . . . . 0.0 110.633 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.34 11.95 14.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.164 -0.96 . . . . 0.0 110.13 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.3 mtm -94.76 -163.83 1.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.918 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 61.3 p -136.54 179.41 6.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 110.318 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -62.58 -30.88 71.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.488 -0.758 . . . . 0.0 109.473 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.502 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 30.1 mt-10 -84.17 -42.68 15.74 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.335 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.02 -40.66 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.49 ' HB3' HG13 ' B' ' 70' ' ' VAL . 75.1 mt-30 -70.69 -36.37 73.25 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.614 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.457 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.881 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -78.04 -27.93 48.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -80.93 -24.3 38.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.592 179.681 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.34 -21.6 28.84 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.45 -0.781 . . . . 0.0 110.314 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.5 ttm -97.07 -14.78 21.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.237 -0.914 . . . . 0.0 110.662 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.9 t -100.65 -39.94 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.168 -0.957 . . . . 0.0 110.379 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.827 ' O ' HD13 ' A' ' 101' ' ' LEU . 1.6 tm? -59.56 -31.37 69.37 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.379 -0.826 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.83 75.44 1.45 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.339 -0.851 . . . . 0.0 110.304 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.35 84.13 0.35 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.59 81.04 5.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.387 -1.066 . . . . 0.0 110.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -140.99 32.79 1.76 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.34 -0.85 . . . . 0.0 110.215 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.31 39.27 2.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.38 -0.825 . . . . 0.0 110.2 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -122.27 76.49 0.35 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.16 60.96 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.198 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.44 74.13 4.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -151.78 107.84 3.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.385 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 14.7 p -110.5 -40.0 4.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.374 -0.829 . . . . 0.0 110.124 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.165 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.452 HG22 HD23 ' B' ' 69' ' ' LEU . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.881 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.5 HD11 HG12 ' B' ' 30' ' ' ILE . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.594 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.477 ' O ' HD12 ' B' ' 56' ' ' LEU . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.689 HG22 ' HE2' ' B' ' 27' ' ' LYS . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.689 ' HE2' HG22 ' B' ' 23' ' ' ILE . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.594 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 15' ' ' LEU . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' B' ' 29' ' ' LYS . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.412 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' B' ' 37' ' ' PRO . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.614 ' NE ' HD11 ' A' ' 93' ' ' ILE . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.78 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.465 HG13 ' HB3' ' A' ' 96' ' ' ALA . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.516 ' HA3' HD23 ' A' ' 101' ' ' LEU . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.78 HD12 ' HB3' ' B' ' 43' ' ' LEU . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.453 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.492 HD22 HG21 ' B' ' 61' ' ' ILE . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.549 ' CG ' HD22 ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.492 HG21 HD22 ' B' ' 56' ' ' LEU . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.505 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.452 HD23 HG22 ' B' ' 7' ' ' THR . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 92' ' ' GLN . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -93.88 103.8 15.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -84.42 94.3 8.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.322 -0.861 . . . . 0.0 110.156 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.67 144.85 44.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -0.874 . . . . 0.0 110.289 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -71.1 96.64 1.37 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.38 -0.825 . . . . 0.0 110.118 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.29 156.0 15.94 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 118.046 -1.419 . . . . 0.0 109.632 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.207 0.527 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.456 ' C ' HD22 ' A' ' 3' ' ' LEU . 2.0 ttp -160.86 -172.6 3.55 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -0.84 . . . . 0.0 110.16 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.9 mm? -112.77 25.63 11.26 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.42 -0.8 . . . . 0.0 109.572 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.93 70.78 2.96 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.29 95.47 4.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.365 -1.08 . . . . 0.0 110.252 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.1 -98.8 0.97 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.07 46.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.301 -1.117 . . . . 0.0 110.223 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -150.11 24.99 0.82 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.356 -0.84 . . . . 0.0 110.363 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -112.22 -10.49 13.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 110.502 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.577 ' HB2' HG11 ' A' ' 14' ' ' VAL . 46.4 p90 -131.65 36.12 3.76 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.179 -0.95 . . . . 0.0 110.355 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.93 37.47 3.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.392 -0.818 . . . . 0.0 110.123 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 13' ' ' GLY . 51.8 p90 -170.52 -37.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.434 ' N ' ' CD2' ' A' ' 12' ' ' PHE . . . -107.95 38.43 3.33 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 10' ' ' PHE . 31.9 m -128.97 -40.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.237 -1.155 . . . . 0.0 110.275 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.491 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.7 OUTLIER -167.25 149.35 5.5 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.274 -0.891 . . . . 0.0 110.078 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.7 -14.71 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 123.794 1.418 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.7 p -74.73 -4.27 36.46 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.245 -0.909 . . . . 0.0 110.713 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.39 6.0 40.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.164 -0.96 . . . . 0.0 110.473 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -163.96 114.89 0.98 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.198 -0.939 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.487 ' N ' HD22 ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 24' ' ' LEU . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE2' HG12 ' A' ' 28' ' ' VAL . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.561 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.29 -21.66 66.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 23.48 6.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.345 -0.847 . . . . 0.0 110.363 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -126.62 -45.32 1.63 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.824 . . . . 0.0 110.095 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.04 -33.68 9.62 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.468 -0.77 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.25 -35.53 70.08 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.636 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.8 tp -69.5 82.13 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.474 -1.015 . . . . 0.0 110.013 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -49.4 148.24 2.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.602 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -61.81 139.38 58.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.475 -0.765 . . . . 0.0 110.395 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.48 -165.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.395 -0.816 . . . . 0.0 109.976 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.93 30.29 5.1 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 59' ' ' THR . 9.7 t -95.38 64.86 2.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -1.054 . . . . 0.0 110.255 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -117.61 91.72 3.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.387 -0.821 . . . . 0.0 110.202 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.79 -43.21 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.341 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.1 70.72 0.98 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -77.02 -56.12 4.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.281 -0.887 . . . . 0.0 110.105 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.452 ' HA ' HD13 ' A' ' 66' ' ' LEU . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -85.82 -37.41 19.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -80.95 -43.73 19.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.372 -0.83 . . . . 0.0 110.332 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.39 109.93 12.99 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.325 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -127.73 78.99 0.38 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.98 99.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -151.3 77.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -0.859 . . . . 0.0 110.209 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.83 41.01 1.73 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.52 148.84 1.55 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.312 -1.111 . . . . 0.0 108.937 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.57 63.7 2.96 Favored 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 123.638 1.336 . . . . 0.0 110.24 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.38 122.26 13.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.415 -0.803 . . . . 0.0 110.17 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD21 ' HB3' ' B' ' 8' ' ' LEU . 1.0 OUTLIER -80.8 -37.66 29.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.208 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.3 p -61.49 -20.99 63.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.421 -0.799 . . . . 0.0 110.422 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.0 t -86.45 -31.04 21.59 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.077 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 10.0 mtm -76.59 121.33 23.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 109.996 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -79.74 -165.02 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.35 -0.844 . . . . 0.0 110.589 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.514 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -66.02 -31.71 72.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.5 -0.75 . . . . 0.0 109.301 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . 0.515 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 9.2 mt-10 -85.35 -40.56 16.38 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.83 -44.91 91.81 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.626 ' HB3' HG13 ' B' ' 70' ' ' VAL . 63.6 mt-30 -67.17 -33.53 75.59 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.716 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -78.76 -35.01 45.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.495 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 2.0 mtt -79.18 -26.65 42.65 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.218 -0.926 . . . . 0.0 109.597 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.8 tp60 -87.65 -23.0 24.38 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.539 -0.725 . . . . 0.0 110.284 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.3 tpp -96.09 -19.83 19.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.289 -0.882 . . . . 0.0 110.617 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 m -95.52 -32.79 12.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.181 -0.949 . . . . 0.0 110.519 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.53 HD23 ' N ' ' A' ' 102' ' ' GLN . 0.2 OUTLIER -59.57 -27.64 66.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.316 -0.865 . . . . 0.0 109.954 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLN . . . . . 0.53 ' N ' HD23 ' A' ' 101' ' ' LEU . 75.5 mm-40 -74.79 -37.68 62.33 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.293 -0.88 . . . . 0.0 110.356 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.09 112.74 0.27 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.22 81.33 1.42 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.372 -1.076 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.03 -55.82 3.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.416 -0.803 . . . . 0.0 110.083 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -110.53 49.09 0.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 110.05 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 91.76 0.07 OUTLIER Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.22 66.24 0.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.437 -1.037 . . . . 0.0 110.107 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.2 67.57 0.95 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.285 -0.884 . . . . 0.0 110.34 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -114.81 -52.35 2.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.9 p -148.69 130.29 14.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.198 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.249 179.95 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.598 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HG2' HG23 ' B' ' 12' ' ' THR . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LEU . . . . . 0.645 ' HB3' HD21 ' A' ' 84' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.426 HG23 ' HG2' ' B' ' 6' ' ' LYS . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.601 HD23 ' HE3' ' B' ' 33' ' ' LYS . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.598 HG23 ' SD ' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' ILE . . . . . 0.567 HG23 HD12 ' B' ' 43' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LYS . . . . . 0.484 ' HE2' HG22 ' B' ' 23' ' ' ILE . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LYS . . . . . 0.544 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.568 HG12 HD11 ' B' ' 15' ' ' LEU . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LYS . . . . . 0.601 ' HE3' HD23 ' B' ' 15' ' ' LEU . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.537 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' GLN . . . . . 0.537 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.485 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' PHE . . . . . 0.552 ' HB2' HD23 ' B' ' 67' ' ' LEU . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' GLY . . . . . 0.495 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.677 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' TYR . . . . . 0.677 ' CG ' HD22 ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ILE . . . . . 0.599 HD13 HD21 ' B' ' 67' ' ' LEU . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' SER . . . . . 0.412 ' HB3' HG23 ' B' ' 61' ' ' ILE . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.599 HD21 HD13 ' B' ' 61' ' ' ILE . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 92' ' ' GLN . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.94 124.84 38.21 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' ARG . . . . . 0.435 ' HA ' ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -76.01 73.13 2.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.42 -0.8 . . . . 0.0 110.157 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.11 110.07 22.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.355 -0.841 . . . . 0.0 110.274 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -75.09 178.44 5.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.403 -0.811 . . . . 0.0 110.141 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.69 -130.42 2.44 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.901 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.775 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.433 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 121.276 0.56 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.484 ' HB3' HG13 ' B' ' 70' ' ' VAL . 37.4 mt-30 . . . . . 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.486 HG12 HD11 ' B' ' 44' ' ' ILE . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.642 ' CD2' HD23 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.529 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.784 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.642 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.74 HD23 ' HE3' ' B' ' 33' ' ' LYS . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.784 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.405 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.578 HG23 HD12 ' B' ' 43' ' ' LEU . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.621 HG12 HD11 ' B' ' 15' ' ' LEU . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.74 ' HE3' HD23 ' B' ' 15' ' ' LEU . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.525 HG23 ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.73 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.486 HD11 HG12 ' A' ' 93' ' ' ILE . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.497 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.423 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' B' ' 56' ' ' LEU . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' B' ' 45' ' ' PHE . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.529 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.512 HG22 ' HB2' ' A' ' 96' ' ' ALA . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.427 ' O ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.323 0.582 . . . . 0.0 110.124 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.402 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.646 ' HB3' HG13 ' B' ' 70' ' ' VAL . 60.4 mt-30 . . . . . 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.623 ' CD2' HD23 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.597 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.803 HD13 HG21 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' B' ' 12' ' ' THR . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.576 HG23 ' CE1' ' B' ' 4' ' ' PHE . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.803 HG21 HD13 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.748 HG23 HD12 ' B' ' 43' ' ' LEU . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.616 ' HE3' HG22 ' B' ' 23' ' ' ILE . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' B' ' 17' ' ' VAL . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.52 HG23 ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.52 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.748 HD12 HG23 ' B' ' 23' ' ' ILE . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.597 HG21 ' C ' ' A' ' 96' ' ' ALA . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.626 HD22 ' CG ' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.507 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.626 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.446 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 92' ' ' GLN . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 71' ' ' LEU . 10.1 mt . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.797 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 24' ' ' LEU . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.552 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.259 0.552 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.628 ' HB3' HG13 ' B' ' 70' ' ' VAL . 79.6 mt-30 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.545 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.83 ' CD2' HD23 ' B' ' 8' ' ' LEU . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.726 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.83 HD23 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.715 ' C ' HD12 ' B' ' 15' ' ' LEU . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.715 HD12 ' C ' ' B' ' 14' ' ' THR . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.405 HG12 ' CD ' ' B' ' 29' ' ' LYS . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.452 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.582 HG23 HD12 ' B' ' 43' ' ' LEU . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.523 ' HE2' HG22 ' B' ' 23' ' ' ILE . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.405 ' CD ' HG12 ' B' ' 17' ' ' VAL . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.4 ' CE ' ' HG ' ' B' ' 15' ' ' LEU . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.541 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.545 ' NE ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.787 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.787 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.458 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' B' ' 61' ' ' ILE . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.734 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.569 HD12 ' HA ' ' B' ' 56' ' ' LEU . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.41 HD21 HD13 ' B' ' 61' ' ' ILE . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.628 HG13 ' HB3' ' A' ' 92' ' ' GLN . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 71' ' ' LEU . 12.7 mt . . . . . 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 24' ' ' LEU . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.541 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.282 0.563 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.609 ' HB3' HG13 ' B' ' 70' ' ' VAL . 39.5 mt-30 . . . . . 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.789 ' CD2' HD23 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.625 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.694 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.705 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.789 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.705 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.694 HG23 ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.476 ' O ' HD12 ' B' ' 56' ' ' LEU . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.595 HG23 HD12 ' B' ' 43' ' ' LEU . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.416 ' CD ' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.503 HG23 ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.409 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.437 ' HB2' ' HB ' ' B' ' 70' ' ' VAL . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.802 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.643 ' HB2' HD23 ' B' ' 67' ' ' LEU . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.523 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.598 ' CD2' HD22 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.581 HD12 ' HA ' ' B' ' 56' ' ' LEU . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.643 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.665 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.665 ' N ' HD23 ' B' ' 69' ' ' LEU . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt . . . . . 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.833 0.349 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.645 ' O ' HG23 ' A' ' 28' ' ' VAL . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.447 ' O ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 24' ' ' LEU . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.175 0.512 . . . . 0.0 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 . . . . . 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.479 ' HB3' HG13 ' B' ' 70' ' ' VAL . 32.8 mt-30 . . . . . 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.422 HG22 ' N ' ' A' ' 94' ' ' ALA . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.422 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.747 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.564 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.449 HD13 HG21 ' B' ' 17' ' ' VAL . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.456 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.567 HG22 HD23 ' B' ' 69' ' ' LEU . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.774 ' C ' HD12 ' B' ' 15' ' ' LEU . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.774 HD12 ' C ' ' B' ' 14' ' ' THR . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.564 HG23 ' SD ' ' B' ' 1' ' ' MET . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.423 ' O ' HD22 ' B' ' 56' ' ' LEU . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.445 ' O ' HD13 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.79 HG21 HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.535 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.535 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.841 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 96' ' ' ALA . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.644 ' HB3' HD21 ' B' ' 50' ' ' LEU . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.841 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.805 ' HA ' HD12 ' B' ' 61' ' ' ILE . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.524 ' CG ' HD22 ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.532 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.567 HD23 HG22 ' B' ' 7' ' ' THR . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.812 0.339 . . . . 0.0 110.53 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.456 ' N ' HD12 ' A' ' 22' ' ' LEU . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.736 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 24' ' ' LEU . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.222 0.534 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.61 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.428 HD11 ' HD2' ' B' ' 42' ' ' ARG . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.785 ' CD2' HD23 ' B' ' 8' ' ' LEU . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.807 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.475 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' B' ' 14' ' ' THR . 0.2 OUTLIER -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.518 HD13 HG21 ' B' ' 17' ' ' VAL . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.529 HG22 HD23 ' B' ' 69' ' ' LEU . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.785 HD23 ' CD2' ' A' ' 95' ' ' TYR . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.529 ' O ' HD12 ' B' ' 15' ' ' LEU . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.562 HD23 ' HB3' ' B' ' 29' ' ' LYS . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.518 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.431 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.562 ' HB3' HD23 ' B' ' 15' ' ' LEU . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.546 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HD2' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.807 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.629 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' B' ' 43' ' ' LEU . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.475 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.431 HD12 ' O ' ' B' ' 18' ' ' GLU . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.579 ' CG ' HD22 ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.629 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.529 HD23 HG22 ' B' ' 7' ' ' THR . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.61 HG13 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.0 t0 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.312 0.577 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 70' ' ' THR . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 66' ' ' LEU . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.5 mt-30 . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 17' ' ' VAL . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.598 HG22 HD23 ' B' ' 69' ' ' LEU . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.487 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.561 HD11 HG12 ' B' ' 30' ' ' ILE . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.401 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.459 ' O ' HD12 ' B' ' 56' ' ' LEU . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.847 HG23 HD12 ' B' ' 43' ' ' LEU . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.422 HG21 HD21 ' B' ' 56' ' ' LEU . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.561 HG12 HD11 ' B' ' 15' ' ' LEU . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HG3' HD22 ' B' ' 15' ' ' LEU . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.466 HG23 ' HD2' ' B' ' 37' ' ' PRO . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.466 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.426 ' CG ' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.488 ' O ' HD12 ' B' ' 69' ' ' LEU . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 23' ' ' ILE . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.435 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.482 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.848 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.454 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.459 HD12 ' O ' ' B' ' 18' ' ' GLU . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.848 ' CG ' HD22 ' B' ' 50' ' ' LEU . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.431 HD13 HD21 ' B' ' 67' ' ' LEU . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HG22 ' B' ' 7' ' ' THR . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.57 HG13 ' HB3' ' A' ' 92' ' ' GLN . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 22' ' ' LEU . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.74 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.514 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.321 0.581 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' B' ' 70' ' ' VAL . 36.7 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.72 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB2' ' CG2' ' B' ' 70' ' ' VAL . . . . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 12' ' ' THR . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.72 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 6' ' ' LYS . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.401 HD11 HG12 ' B' ' 30' ' ' ILE . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.455 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.526 HD13 HD13 ' B' ' 69' ' ' LEU . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.484 HG23 ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 10.2 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.426 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.459 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 61' ' ' ILE . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.533 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' B' ' 56' ' ' LEU . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.465 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.426 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.526 HD13 HD13 ' B' ' 30' ' ' ILE . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 92' ' ' GLN . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.703 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 24' ' ' LEU . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.413 ' OE2' HG12 ' A' ' 28' ' ' VAL . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ARG . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 121.266 0.555 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 71' ' ' ILE . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.48 ' N ' HG23 ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.721 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.7 mt-30 . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.77 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.459 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' B' ' 12' ' ' THR . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.455 ' HA ' ' CE2' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.562 HD11 HG12 ' B' ' 30' ' ' ILE . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.573 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CD ' HG12 ' B' ' 17' ' ' VAL . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.562 HG12 HD11 ' B' ' 15' ' ' LEU . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.489 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.908 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.77 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.908 HD12 ' HB3' ' B' ' 43' ' ' LEU . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.41 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' B' ' 61' ' ' ILE . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.71 ' CD2' HD22 ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 92' ' ' GLN . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 121.287 0.565 . . . . 0.0 110.233 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.657 ' HB3' HG13 ' B' ' 70' ' ' VAL . 80.0 mt-30 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.545 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.66 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.54 HD13 HG21 ' B' ' 17' ' ' VAL . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.556 HD11 ' OE2' ' B' ' 34' ' ' GLU . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.775 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.775 HD12 ' C ' ' B' ' 14' ' ' THR . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.54 HG21 HD13 ' B' ' 3' ' ' ILE . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.706 ' O ' HD12 ' B' ' 56' ' ' LEU . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.504 ' HB3' HD23 ' B' ' 15' ' ' LEU . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD13 ' B' ' 69' ' ' LEU . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . 0.556 ' OE2' HD11 ' B' ' 13' ' ' ILE . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.799 ' HB3' HD12 ' B' ' 50' ' ' LEU . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.623 ' HB2' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.706 HD12 ' O ' ' B' ' 18' ' ' GLU . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.509 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.707 HD22 ' N ' ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.486 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 92' ' ' GLN . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.835 0.35 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.77 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 24' ' ' LEU . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.692 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.692 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.587 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.587 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.494 1.743 0 CA-C-O 121.153 0.502 . . . . 0.0 110.332 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.671 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.2 mt-30 . . . . . 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.763 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.752 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.48 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.413 HG22 ' CD2' ' B' ' 69' ' ' LEU . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.763 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 30' ' ' ILE . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.586 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.534 ' O ' HD12 ' B' ' 56' ' ' LEU . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.586 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.427 HG12 HD11 ' B' ' 15' ' ' LEU . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.49 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.791 ' C ' HD12 ' B' ' 44' ' ' ILE . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.546 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.69 HD22 ' CG ' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.435 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' B' ' 61' ' ' ILE . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.69 ' CG ' HD22 ' B' ' 50' ' ' LEU . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.546 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.671 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 26' ' ' LEU . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.365 0.602 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.959 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.959 ' N ' HD13 ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 4.7 mm-40 . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.811 ' CD2' HD13 ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.709 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.518 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.577 HD12 HD22 ' B' ' 67' ' ' LEU . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.532 HD11 HG12 ' B' ' 30' ' ' ILE . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.598 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.544 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.42 ' CE ' HG22 ' B' ' 23' ' ' ILE . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.598 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.532 HG12 HD11 ' B' ' 15' ' ' LEU . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.487 ' C ' HD22 ' B' ' 43' ' ' LEU . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.487 HD22 ' C ' ' B' ' 42' ' ' ARG . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.709 HG21 ' HB1' ' A' ' 96' ' ' ALA . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.787 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.481 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.62 ' HA ' HD12 ' B' ' 61' ' ' ILE . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.787 ' CG ' HD22 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 3' ' ' ILE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.607 HG13 ' HB3' ' A' ' 92' ' ' GLN . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.726 0.298 . . . . 0.0 110.592 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 26' ' ' LEU . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 24' ' ' LEU . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG2' ' HA ' ' A' ' 29' ' ' SER . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.689 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.689 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.719 0 CA-C-O 121.276 0.56 . . . . 0.0 110.107 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 71' ' ' ILE . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 47.7 mt-30 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.649 ' CD2' HD13 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.445 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.494 HD13 HG21 ' B' ' 17' ' ' VAL . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.7 ' CE1' HG23 ' B' ' 14' ' ' THR . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.649 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 13' ' ' ILE . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.7 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.494 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.668 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.632 HG23 HD12 ' B' ' 43' ' ' LEU . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.498 HG23 ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.498 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.427 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.632 HD12 HG23 ' B' ' 23' ' ' ILE . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.646 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.429 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.668 HD12 ' O ' ' B' ' 18' ' ' GLU . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.646 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.429 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.523 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.652 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.652 ' N ' HD23 ' B' ' 69' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mt . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 26' ' ' LEU . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.28 0.562 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.971 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.971 ' N ' HD13 ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.689 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.693 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.596 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.489 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.595 HD12 HD22 ' B' ' 67' ' ' LEU . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.693 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.769 ' C ' HD12 ' B' ' 15' ' ' LEU . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.769 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.489 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.606 HG23 HD12 ' B' ' 43' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.474 ' CD ' HG12 ' B' ' 17' ' ' VAL . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.452 HG23 ' HD2' ' B' ' 37' ' ' PRO . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.455 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.455 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.672 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.672 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.808 HD22 ' CD2' ' B' ' 59' ' ' TYR . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' B' ' 61' ' ' ILE . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.808 ' CD2' HD22 ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.432 HD12 ' HA ' ' B' ' 56' ' ' LEU . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.595 HD22 HD12 ' B' ' 3' ' ' ILE . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 92' ' ' GLN . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.715 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 24' ' ' LEU . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 121.195 0.521 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.663 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.629 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.3 mt-30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.752 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD2' HD13 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.738 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.463 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . 0.41 HD12 HD22 ' B' ' 67' ' ' LEU . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' B' ' 12' ' ' THR . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.589 ' HG2' HG23 ' B' ' 12' ' ' THR . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.492 HG22 HD23 ' B' ' 69' ' ' LEU . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.589 HG23 ' HG2' ' B' ' 6' ' ' LYS . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.481 HD11 HG12 ' B' ' 30' ' ' ILE . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.624 HG12 ' HD3' ' B' ' 29' ' ' LYS . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.696 HG23 HD12 ' B' ' 43' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.414 ' HE2' HG22 ' B' ' 23' ' ' ILE . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.624 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.481 HG12 HD11 ' B' ' 15' ' ' LEU . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.752 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.798 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.798 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.472 ' HB3' HD21 ' B' ' 50' ' ' LEU . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.649 HD22 ' CG ' ' B' ' 59' ' ' TYR . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.488 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.649 ' CG ' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.446 HD23 HD22 ' B' ' 43' ' ' LEU . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.492 HD23 HG22 ' B' ' 7' ' ' THR . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.629 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt . . . . . 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 24' ' ' LEU . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.204 0.526 . . . . 0.0 110.085 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 66' ' ' LEU . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 . . . . . 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.711 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.493 HD11 ' CZ ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.74 ' CD2' HD13 ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.792 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.409 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . 0.725 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.725 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 1' ' ' MET . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . 0.571 HG21 HD21 ' B' ' 56' ' ' LEU . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.604 HD13 HD12 ' B' ' 69' ' ' LEU . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.493 ' CZ ' HD11 ' A' ' 93' ' ' ILE . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.784 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.792 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 67' ' ' LEU . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.782 HD22 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.782 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.715 HD12 ' HA ' ' B' ' 56' ' ' LEU . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.621 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.711 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.69 ' O ' HD23 ' A' ' 24' ' ' LEU . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 26' ' ' LEU . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 24' ' ' LEU . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . . . . . . 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 N--CA 1.493 1.725 0 CA-C-O 121.216 0.531 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 71' ' ' ILE . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' LYS . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 . . . . . 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.49 ' HB3' HG13 ' B' ' 70' ' ' VAL . 75.1 mt-30 . . . . . 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.614 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.457 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.881 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.452 HG22 HD23 ' B' ' 69' ' ' LEU . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.881 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.5 HD11 HG12 ' B' ' 30' ' ' ILE . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.594 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.477 ' O ' HD12 ' B' ' 56' ' ' LEU . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.689 HG22 ' HE2' ' B' ' 27' ' ' LYS . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.689 ' HE2' HG22 ' B' ' 23' ' ' ILE . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.594 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 15' ' ' LEU . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' B' ' 29' ' ' LYS . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.412 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' B' ' 37' ' ' PRO . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.614 ' NE ' HD11 ' A' ' 93' ' ' ILE . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.78 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.465 HG13 ' HB3' ' A' ' 96' ' ' ALA . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.78 HD12 ' HB3' ' B' ' 43' ' ' LEU . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.453 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.492 HD22 HG21 ' B' ' 61' ' ' ILE . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.549 ' CG ' HD22 ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.492 HG21 HD22 ' B' ' 56' ' ' LEU . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.505 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.452 HD23 HG22 ' B' ' 7' ' ' THR . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 92' ' ' GLN . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 24' ' ' LEU . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE2' HG12 ' A' ' 28' ' ' VAL . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.561 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 121.219 0.533 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 66' ' ' LEU . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.626 ' HB3' HG13 ' B' ' 70' ' ' VAL . 63.6 mt-30 . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.485 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.716 ' C ' HG21 ' B' ' 44' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.598 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HG2' HG23 ' B' ' 12' ' ' THR . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' LEU . . . . . 0.512 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.426 HG23 ' HG2' ' B' ' 6' ' ' LYS . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.601 HD23 ' HE3' ' B' ' 33' ' ' LYS . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.598 HG23 ' SD ' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . 0.567 HG23 HD12 ' B' ' 43' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LYS . . . . . 0.484 ' HE2' HG22 ' B' ' 23' ' ' ILE . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LYS . . . . . 0.544 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.568 HG12 HD11 ' B' ' 15' ' ' LEU . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LYS . . . . . 0.601 ' HE3' HD23 ' B' ' 15' ' ' LEU . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.537 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' GLN . . . . . 0.537 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.485 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' PHE . . . . . 0.552 ' HB2' HD23 ' B' ' 67' ' ' LEU . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.677 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' TYR . . . . . 0.677 ' CG ' HD22 ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ILE . . . . . 0.599 HD13 HD21 ' B' ' 67' ' ' LEU . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' SER . . . . . 0.412 ' HB3' HG23 ' B' ' 61' ' ' ILE . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.599 HD21 HD13 ' B' ' 61' ' ' ILE . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 92' ' ' GLN . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt . . . . . 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.156 0.503 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -148.19 -168.31 3.05 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.452 -0.78 . . . . 0.0 110.156 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.3 mt -112.46 27.53 9.56 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.412 -0.805 . . . . 0.0 109.423 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.38 -39.28 5.1 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.729 -1.349 . . . . 0.0 109.729 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -148.87 33.81 0.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -1.089 . . . . 0.0 110.23 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -114.94 -80.25 0.89 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -107.23 25.08 11.85 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.341 -1.094 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.1 p -119.88 28.74 7.93 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.357 -0.84 . . . . 0.0 110.16 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.4 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 6.4 p-10 -124.2 26.99 7.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.312 -0.868 . . . . 0.0 110.156 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.4 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 95.9 m-85 -123.71 0.3 8.68 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.367 -0.833 . . . . 0.0 110.563 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -59.91 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.183 -0.948 . . . . 0.0 110.504 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 52.26 27.32 4.63 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.314 -0.866 . . . . 0.0 110.462 179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -126.18 28.56 4.8 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -101.03 -51.98 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.365 -1.079 . . . . 0.0 109.98 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.537 ' OD1' ' HB2' ' A' ' 18' ' ' ALA . 11.2 p-10 -162.72 154.29 15.21 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.378 -0.826 . . . . 0.0 110.124 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.09 -30.89 12.91 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 O-C-N 123.775 1.408 . . . . 0.0 110.605 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.8 m -72.33 -6.88 46.35 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.265 -0.897 . . . . 0.0 110.8 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.537 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . . . -84.29 3.28 36.27 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.148 -0.97 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -169.6 120.14 0.59 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.108 -0.995 . . . . 0.0 109.937 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.26 -14.55 34.63 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 O-C-N 123.942 1.496 . . . . 0.0 110.258 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -79.69 -32.47 41.41 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.348 -0.845 . . . . 0.0 109.521 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.12 -26.96 21.05 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.627 -0.67 . . . . 0.0 109.5 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.72 -39.17 64.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.49 -0.756 . . . . 0.0 109.536 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.775 ' O ' HG23 ' A' ' 28' ' ' VAL . 4.3 mm? -78.84 -33.91 45.59 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.463 -0.773 . . . . 0.0 109.69 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.92 -41.95 98.52 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.386 -0.821 . . . . 0.0 109.768 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.49 -21.44 52.81 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.484 -0.76 . . . . 0.0 110.084 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -83.8 -29.8 27.07 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.296 -0.877 . . . . 0.0 109.659 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.775 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.5 t -77.25 -32.06 18.72 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.443 -0.786 . . . . 0.0 109.804 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 m -76.33 -39.34 54.25 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.434 -0.791 . . . . 0.0 109.92 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.63 -38.56 91.41 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.404 -0.81 . . . . 0.0 110.006 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -70.88 -37.98 73.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.408 -0.808 . . . . 0.0 110.172 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -60.47 -46.77 88.88 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.439 -0.788 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -37.23 83.29 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.115 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.75 -39.04 90.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.439 -0.788 . . . . 0.0 109.851 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -63.21 -37.59 87.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.372 -0.83 . . . . 0.0 109.879 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -44.49 72.53 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.443 -0.785 . . . . 0.0 109.947 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.525 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -73.9 -18.2 60.94 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.818 . . . . 0.0 110.21 179.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -83.94 -63.32 1.37 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.366 -0.834 . . . . 0.0 109.458 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.19 -27.15 20.12 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.425 -0.797 . . . . 0.0 109.252 179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -86.85 -27.46 23.46 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.584 -0.698 . . . . 0.0 109.785 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -84.81 -24.79 28.52 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.172 -0.955 . . . . 0.0 109.685 179.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.433 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 6.4 mpt_? -82.39 -41.54 19.8 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.575 -0.703 . . . . 0.0 109.908 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -71.28 -34.8 71.01 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.44 -0.788 . . . . 0.0 109.924 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.43 -40.12 74.0 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.426 -0.796 . . . . 0.0 109.939 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -68.97 -33.76 74.21 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.389 -0.819 . . . . 0.0 110.012 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.67 -44.38 70.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 110.065 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -61.4 -49.57 76.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.358 -0.839 . . . . 0.0 110.011 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.9 -25.46 65.51 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.838 . . . . 0.0 110.088 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -72.45 -20.31 61.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.414 -0.804 . . . . 0.0 110.316 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -93.19 19.11 8.42 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.234 -0.916 . . . . 0.0 110.395 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -127.3 -43.24 1.63 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 109.986 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.93 -43.18 5.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 110.088 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -113.55 71.25 0.23 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.5 tt -61.14 -18.31 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.332 -1.099 . . . . 0.0 110.459 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.73 -173.16 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.316 -0.865 . . . . 0.0 110.394 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 9.6 t -58.12 162.49 3.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.272 -0.892 . . . . 0.0 110.374 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 24.5 m -152.71 -58.24 0.14 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.443 -0.786 . . . . 0.0 110.164 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -163.62 -56.54 0.02 OUTLIER Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.9 p -136.11 90.12 2.55 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -1.069 . . . . 0.0 110.105 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.6 52.73 1.94 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.326 -0.859 . . . . 0.0 110.217 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.98 -53.66 4.76 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.353 -0.842 . . . . 0.0 110.231 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.84 73.29 1.01 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.378 -0.827 . . . . 0.0 110.284 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -74.53 -62.71 1.43 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.349 -0.844 . . . . 0.0 110.066 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -74.07 -26.81 60.59 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.313 -0.867 . . . . 0.0 109.024 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.82 -40.04 96.16 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 119.661 -0.816 . . . . 0.0 108.812 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.5 tt -68.29 -30.6 69.65 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.6 tt -75.07 -42.44 56.88 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.536 -0.727 . . . . 0.0 109.858 179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -53.0 7.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.444 -0.785 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 tpt -52.92 -38.12 61.51 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.311 -0.868 . . . . 0.0 110.753 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 52.2 m -71.73 -41.65 68.24 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.338 -0.851 . . . . 0.0 110.665 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.6 tp -83.3 -15.8 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.06 -1.025 . . . . 0.0 110.374 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.2 p -76.18 -39.69 54.23 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.294 -0.879 . . . . 0.0 109.624 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -26.52 36.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.452 -0.78 . . . . 0.0 109.74 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -85.14 -51.17 6.82 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.393 -0.817 . . . . 0.0 110.024 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.27 -27.79 69.58 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.382 -0.824 . . . . 0.0 110.12 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 53.5 t80 -95.62 36.57 1.26 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.354 -0.841 . . . . 0.0 110.271 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -123.27 89.93 0.42 Allowed Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 52.66 94.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.408 -1.054 . . . . 0.0 110.436 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -126.99 29.02 5.7 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.477 -0.764 . . . . 0.0 110.19 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.477 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -97.91 25.52 27.15 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.4 OUTLIER -161.5 150.13 12.94 Favored Pre-proline 0 N--CA 1.485 1.323 0 O-C-N 121.477 -1.014 . . . . 0.0 108.525 179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' O ' ' HB2' ' A' ' 83' ' ' ASP . 53.6 Cg_endo -77.78 31.45 0.43 Allowed 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 123.473 1.249 . . . . 0.0 110.832 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' A' ' 82' ' ' PRO . 39.7 m-20 60.14 149.29 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.373 -0.83 . . . . 0.0 110.208 -179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.744 HD22 HD13 ' B' ' 8' ' ' LEU . 96.7 mt -135.66 -72.63 0.46 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 110.266 -179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 78.3 p -73.15 -7.01 49.52 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.412 -0.805 . . . . 0.0 110.667 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.7 m -79.63 -20.32 47.05 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.243 -0.91 . . . . 0.0 110.17 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.45 ' HB2' ' HB3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -108.43 -142.5 0.38 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.268 -0.895 . . . . 0.0 110.122 179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 81.2 p -135.1 179.73 6.14 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.886 -1.134 . . . . 0.0 110.76 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.568 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.9 pt-20 -66.05 -29.38 69.72 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.575 -0.703 . . . . 0.0 109.361 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.513 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.8 mp0 -78.44 -40.97 34.16 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.45 ' HB3' ' HB2' ' A' ' 87' ' ' MET . 0.2 OUTLIER -64.3 -42.13 96.52 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.15 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.484 ' HB3' HG13 ' B' ' 70' ' ' VAL . 37.4 mt-30 -69.17 -33.92 74.14 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 107.588 -1.264 . . . . 0.0 107.588 177.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.568 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -63.78 -41.44 92.58 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 178.449 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.27 -36.76 68.94 Favored 'General case' 0 N--CA 1.493 1.686 0 CA-C-O 121.861 0.839 . . . . 0.0 108.782 178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.642 ' CD2' HD23 ' B' ' 8' ' ' LEU . 30.8 t80 -62.51 -51.87 65.72 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.208 0.528 . . . . 0.0 110.258 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.529 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -68.87 -35.97 77.53 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.422 -0.799 . . . . 0.0 110.595 -179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.578 ' SD ' HD12 ' B' ' 44' ' ' ILE . 0.0 OUTLIER -74.5 -32.68 62.59 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.103 -0.998 . . . . 0.0 109.101 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -68.15 -28.63 67.47 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 120.05 -0.66 . . . . 0.0 110.016 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 8.1 mtt -93.45 -30.28 15.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.44 -0.787 . . . . 0.0 110.153 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 63.3 m -60.87 -56.7 18.06 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 110.149 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.424 HD12 ' C ' ' A' ' 101' ' ' LEU . 3.7 pp -69.88 -12.03 61.31 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.404 -0.81 . . . . 0.0 110.496 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -101.07 34.12 2.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.247 -0.908 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.82 -80.35 1.06 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -101.64 89.1 3.59 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.364 -1.08 . . . . 0.0 110.192 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -143.89 78.14 1.58 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.345 -0.847 . . . . 0.0 110.18 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -112.88 64.27 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.335 -0.853 . . . . 0.0 110.078 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 134.91 -30.25 2.86 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.09 89.49 3.63 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.393 -1.063 . . . . 0.0 110.057 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -112.15 -139.95 0.38 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.951 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -111.7 59.66 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.166 -0.959 . . . . 0.0 110.27 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 66.1 m -84.96 158.15 20.61 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.303 -0.873 . . . . 0.0 110.177 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.187 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ptt? . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 121.289 0.566 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 2.5 tt0 -111.14 146.72 36.35 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.542 -0.724 . . . . 0.0 110.021 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.784 HD13 HG21 ' B' ' 17' ' ' VAL . 43.2 pt -137.56 159.68 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -111.98 143.83 42.32 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.499 -0.75 . . . . 0.0 110.604 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.45 ' O ' ' HA ' ' B' ' 12' ' ' THR . 89.4 t -127.96 123.09 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.501 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 17.5 mtmt -99.92 130.44 46.1 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.5 -0.75 . . . . 0.0 110.424 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 51.1 p -95.77 178.27 5.5 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.399 -0.813 . . . . 0.0 110.369 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.744 HD13 HD22 ' A' ' 84' ' ' LEU . 7.9 mt -61.44 -16.46 47.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.412 -0.805 . . . . 0.0 110.892 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 76.2 p -95.93 18.86 12.44 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.082 -1.011 . . . . 0.0 110.746 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.72 12.81 60.12 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 110.355 -1.098 . . . . 0.0 110.355 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 18.0 ttpt -84.73 131.33 34.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.062 -1.258 . . . . 0.0 109.77 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 55.6 m -113.02 126.09 55.11 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.289 -0.882 . . . . 0.0 110.34 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.22 141.71 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.435 -0.79 . . . . 0.0 110.259 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 5.8 m -101.84 122.98 45.0 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.416 -0.803 . . . . 0.0 109.381 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.74 HD23 ' HE3' ' B' ' 33' ' ' LYS . 46.6 mt -123.32 162.18 23.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.24 -0.912 . . . . 0.0 110.915 -179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.54 111.04 23.42 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.47 -0.769 . . . . 0.0 109.449 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.784 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.51 168.96 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.301 -0.874 . . . . 0.0 111.032 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.405 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.5 mt-10 -112.69 167.59 8.96 Favored Pre-proline 0 N--CA 1.489 1.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -71.94 -24.73 20.54 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 123.611 1.322 . . . . 0.0 110.472 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -84.41 -5.09 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.225 -0.922 . . . . 0.0 110.503 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -71.33 142.66 50.41 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.127 -0.983 . . . . 0.0 110.554 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 29.4 p -83.3 160.12 21.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.484 -0.76 . . . . 0.0 110.404 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.578 HG23 HD12 ' B' ' 43' ' ' LEU . 41.9 mm -59.64 -39.21 78.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.262 -0.898 . . . . 0.0 109.655 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -35.99 72.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.345 -0.847 . . . . 0.0 109.516 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -70.36 -32.24 69.85 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.426 -0.796 . . . . 0.0 109.34 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -70.22 -40.25 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.48 -0.762 . . . . 0.0 109.089 179.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -62.84 -43.26 99.26 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.492 -0.755 . . . . 0.0 109.224 179.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -33.15 73.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.43 -0.794 . . . . 0.0 109.384 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -68.26 -39.9 82.09 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.509 -0.745 . . . . 0.0 109.47 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.621 HG12 HD11 ' B' ' 15' ' ' LEU . 12.2 mt -67.3 -38.42 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 109.187 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -60.68 -52.52 64.79 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.479 -0.763 . . . . 0.0 109.704 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -58.05 -25.95 61.86 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.393 -0.817 . . . . 0.0 110.457 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.74 ' HE3' HD23 ' B' ' 15' ' ' LEU . 7.1 mmtt -83.96 -40.94 17.88 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.28 -0.888 . . . . 0.0 110.842 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -108.18 -55.61 2.35 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 110.558 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.8 19.43 1.82 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.525 HG23 ' HD2' ' B' ' 37' ' ' PRO . 32.6 mt -91.28 145.33 31.29 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.219 -1.166 . . . . 0.0 109.706 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.4 Cg_endo -67.33 132.29 27.16 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 O-C-N 123.621 1.327 . . . . 0.0 110.414 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.72 -25.75 81.62 Favored 'Trans proline' 0 C--N 1.311 -1.443 0 O-C-N 123.633 1.333 . . . . 0.0 110.739 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -68.94 -23.82 64.2 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.874 . . . . 0.0 109.984 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -101.18 2.72 40.36 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.387 -0.82 . . . . 0.0 110.537 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -94.27 134.8 36.36 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.128 -0.983 . . . . 0.0 110.334 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -129.95 132.21 46.24 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.439 -0.788 . . . . 0.0 109.708 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.73 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.6 mt -104.8 125.88 51.31 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.196 -0.94 . . . . 0.0 110.68 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.578 HD12 ' SD ' ' A' ' 97' ' ' MET . 16.2 mm -120.86 133.68 66.73 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.71 -0.619 . . . . 0.0 109.883 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.497 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.4 t80 -141.4 140.25 33.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.299 -0.876 . . . . 0.0 110.418 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.24 28.62 0.45 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.605 -0.684 . . . . 0.0 111.588 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.04 4.88 90.12 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -111.25 131.23 55.3 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.115 -1.226 . . . . 0.0 110.414 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -78.42 133.3 37.52 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.334 -0.854 . . . . 0.0 109.239 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.73 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.4 mt -83.71 137.32 33.82 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.19 -0.944 . . . . 0.0 110.484 -179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -93.71 133.02 37.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.484 -0.76 . . . . 0.0 110.537 -179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.469 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 68.4 m-20 -48.49 -27.87 2.97 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.437 -0.79 . . . . 0.0 111.036 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.09 -8.54 85.45 Favored Glycine 0 N--CA 1.493 2.481 0 C-N-CA 120.196 -1.002 . . . . 0.0 110.73 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -99.52 156.71 16.9 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.977 -1.308 . . . . 0.0 110.598 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 38.4 p -102.4 162.58 12.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.433 -0.792 . . . . 0.0 110.173 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.423 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.4 mt -53.58 -43.72 68.78 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.347 -0.846 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.7 t -56.69 -33.0 66.01 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.461 -0.774 . . . . 0.0 111.099 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -59.62 -27.97 66.79 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.235 -0.916 . . . . 0.0 110.453 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.582 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.6 m-85 -101.17 25.59 8.01 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.328 -0.857 . . . . 0.0 110.148 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 50.68 31.59 6.01 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.468 -0.77 . . . . 0.0 110.587 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' B' ' 56' ' ' LEU . 99.1 mt -81.43 114.9 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.332 -0.855 . . . . 0.0 110.016 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.76 168.58 9.01 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.434 -0.791 . . . . 0.0 110.252 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.62 154.4 0.31 Allowed 'General case' 0 N--CA 1.498 1.926 0 CA-C-O 121.563 0.697 . . . . 0.0 111.16 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.3 OUTLIER 62.9 14.37 7.39 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.743 -0.598 . . . . 0.0 110.943 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.83 148.38 46.27 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.16 -0.962 . . . . 0.0 110.183 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 44.0 m -107.74 110.86 22.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.29 -0.881 . . . . 0.0 110.085 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.497 HD23 ' HB2' ' B' ' 45' ' ' PHE . 7.8 mt -102.23 159.21 15.59 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 109.876 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.529 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 52.9 m80 -108.52 140.04 42.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.317 -0.865 . . . . 0.0 109.95 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 33.3 tp -107.48 133.98 51.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.203 -0.936 . . . . 0.0 110.641 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.512 HG22 ' HB2' ' A' ' 96' ' ' ALA . 40.7 t -124.77 154.48 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.066 179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 37.8 mt -94.07 129.51 40.58 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.389 -0.819 . . . . 0.0 110.23 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -103.06 124.87 49.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.319 -0.863 . . . . 0.0 110.167 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 mt -109.02 86.81 2.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.378 -0.826 . . . . 0.0 110.193 -179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.82 32.77 0.4 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.289 -0.882 . . . . 0.0 110.067 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.4 114.75 1.34 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.966 -1.463 . . . . 0.0 109.603 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.193 0.52 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.34 -175.52 5.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.408 -0.807 . . . . 0.0 110.239 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.5 pp -109.82 15.26 22.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.444 -0.785 . . . . 0.0 109.913 179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.19 -44.68 6.92 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.1 mt -109.03 -23.13 11.83 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -1.086 . . . . 0.0 110.232 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -70.32 -63.59 3.2 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.41 36.57 20.39 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.29 -1.123 . . . . 0.0 110.305 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 21.5 p -166.13 -37.32 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.465 -0.772 . . . . 0.0 110.392 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -49.86 -28.5 6.58 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.274 -0.891 . . . . 0.0 110.516 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -102.25 89.92 3.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.395 -0.816 . . . . 0.0 109.974 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.76 72.06 1.34 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.341 -0.849 . . . . 0.0 110.454 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 51.32 25.63 2.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.366 -0.833 . . . . 0.0 110.551 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -121.97 47.8 1.0 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 61.4 t -135.48 -66.73 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -1.089 . . . . 0.0 110.08 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -155.54 155.75 30.05 Favored Pre-proline 0 N--CA 1.492 1.666 0 O-C-N 121.355 -0.841 . . . . 0.0 110.109 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.05 -15.56 29.08 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 O-C-N 123.841 1.443 . . . . 0.0 110.666 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.22 -6.65 49.12 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.234 -0.916 . . . . 0.0 110.584 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.68 1.91 53.77 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.124 -0.985 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.22 113.71 1.42 Allowed Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.151 -0.968 . . . . 0.0 109.995 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -70.57 -13.56 32.74 Favored 'Trans proline' 0 C--N 1.306 -1.692 0 O-C-N 123.953 1.501 . . . . 0.0 110.33 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -79.03 -31.61 44.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.312 -0.868 . . . . 0.0 109.474 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.51 -26.69 20.77 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.586 -0.696 . . . . 0.0 109.479 179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.3 -41.02 64.05 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.355 -0.841 . . . . 0.0 109.474 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.79 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -77.33 -30.03 53.82 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.507 -0.745 . . . . 0.0 109.736 179.453 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.89 -40.87 71.95 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.368 -0.833 . . . . 0.0 110.043 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' O ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -73.26 -22.91 60.29 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.356 -0.84 . . . . 0.0 110.224 179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -79.38 -29.15 41.99 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.244 -0.91 . . . . 0.0 109.257 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.79 HG23 ' O ' ' A' ' 24' ' ' LEU . 98.2 t -75.53 -31.3 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.598 -0.689 . . . . 0.0 109.614 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.18 -42.56 62.61 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.425 -0.797 . . . . 0.0 109.899 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -61.78 -41.63 97.96 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.444 -0.785 . . . . 0.0 109.882 179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -67.35 -38.1 84.3 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.502 -0.749 . . . . 0.0 110.103 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -63.93 -46.81 83.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.357 -0.839 . . . . 0.0 110.089 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.3 -38.79 88.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.35 -0.844 . . . . 0.0 109.939 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -35.89 81.7 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.372 -0.83 . . . . 0.0 109.797 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -33.73 76.47 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.402 -0.811 . . . . 0.0 109.697 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -75.67 -46.22 32.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.466 -0.771 . . . . 0.0 110.051 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.0 mm-40 -66.13 -29.48 69.79 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.862 . . . . 0.0 109.901 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.63 -56.94 3.44 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.432 -0.792 . . . . 0.0 109.374 179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -52.53 -32.95 43.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.427 -0.795 . . . . 0.0 109.139 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -84.12 -34.25 24.15 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.13 -49.26 72.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.389 -0.82 . . . . 0.0 109.65 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.3 ptt85 -68.26 -31.84 71.6 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.422 -0.798 . . . . 0.0 109.706 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -38.41 66.42 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.381 -0.824 . . . . 0.0 109.209 179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.54 -29.34 41.38 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.4 -28.14 69.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.519 -0.738 . . . . 0.0 109.767 179.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -88.56 -38.34 14.98 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.404 -0.81 . . . . 0.0 109.988 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.01 -37.93 78.95 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.351 -0.843 . . . . 0.0 110.179 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -41.97 43.51 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.45 -0.781 . . . . 0.0 110.232 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.52 -23.94 64.96 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.315 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.412 ' HB1' ' CG1' ' A' ' 54' ' ' ILE . . . -107.89 -10.63 15.5 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.344 -0.848 . . . . 0.0 110.514 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.35 -46.19 80.07 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.221 -0.924 . . . . 0.0 110.117 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -107.08 21.53 17.41 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.467 -0.77 . . . . 0.0 110.244 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -119.56 -43.65 0.49 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.412 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 1.2 pt -139.77 76.91 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.331 -1.1 . . . . 0.0 110.351 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -149.75 101.12 3.03 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.34 -0.85 . . . . 0.0 110.091 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.0 t -159.01 148.1 18.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.38 -0.825 . . . . 0.0 110.329 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 20.9 p -127.63 77.88 1.78 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.81 94.63 0.14 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.542 HG23 ' O ' ' A' ' 59' ' ' THR . 7.7 t -73.2 67.13 0.92 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.386 -1.067 . . . . 0.0 110.335 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.16 76.16 0.97 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.342 -0.849 . . . . 0.0 110.144 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -166.62 -41.17 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.406 -0.809 . . . . 0.0 110.022 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.518 ' HB2' ' HB3' ' A' ' 65' ' ' ALA . 4.8 p -110.9 67.68 0.65 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.384 -0.822 . . . . 0.0 110.097 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -76.67 -53.53 7.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.285 -0.884 . . . . 0.0 110.124 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -75.78 -29.43 58.75 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.241 -0.912 . . . . 0.0 109.119 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.518 ' HB3' ' HB2' ' A' ' 62' ' ' SER . . . -61.43 -44.43 97.13 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.624 -0.83 . . . . 0.0 108.871 179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.0 tp -65.2 -28.99 69.76 Favored 'General case' 0 N--CA 1.488 1.467 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.42 -36.69 53.01 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.484 -0.76 . . . . 0.0 109.886 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.402 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.4 OUTLIER -83.93 -55.67 4.1 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.519 -0.738 . . . . 0.0 110.447 -179.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 84.5 mmm -53.53 -41.88 66.84 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.112 -0.992 . . . . 0.0 110.695 -179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 92.9 m -70.27 -40.31 74.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.373 -0.829 . . . . 0.0 110.8 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.7 tp -83.19 -15.39 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.148 -0.97 . . . . 0.0 110.315 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 10.6 t -75.53 -43.46 48.7 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.262 -0.899 . . . . 0.0 109.739 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.01 -26.57 43.23 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.441 -0.787 . . . . 0.0 110.066 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -83.69 -46.33 12.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.378 -0.826 . . . . 0.0 110.264 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -62.0 -42.67 99.4 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.285 -0.884 . . . . 0.0 110.197 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -111.58 47.3 1.04 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.402 -0.811 . . . . 0.0 110.212 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -113.15 -46.92 0.68 Allowed Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -87.12 125.4 34.11 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.268 -1.136 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.9 m -154.12 45.48 0.58 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.845 . . . . 0.0 110.107 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.05 56.39 0.94 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.66 147.71 1.69 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.3 -1.118 . . . . 0.0 108.903 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.35 62.7 2.76 Favored 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 123.584 1.307 . . . . 0.0 110.392 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -59.48 99.58 0.06 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.387 -0.821 . . . . 0.0 110.178 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.6 mp -60.81 -41.04 94.91 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.39 -0.819 . . . . 0.0 110.315 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 39.6 m -59.89 -32.58 70.86 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.372 -0.83 . . . . 0.0 110.379 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 12.7 t -82.5 -30.27 29.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.328 -0.857 . . . . 0.0 110.042 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.41 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 16.0 mtp -76.45 117.67 18.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.455 -0.778 . . . . 0.0 110.083 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.446 ' OG1' ' HG2' ' A' ' 90' ' ' GLU . 66.9 p -80.16 -162.27 0.43 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.799 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.403 ' CB ' ' HA ' ' B' ' 72' ' ' ARG . 16.9 pt-20 -68.69 -31.98 71.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.488 -0.758 . . . . 0.0 109.53 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.6 pt-20 -85.55 -36.87 20.18 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 0.5 OUTLIER -66.26 -48.03 71.8 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 178.206 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.646 ' HB3' HG13 ' B' ' 70' ' ' VAL . 60.4 mt-30 -63.27 -33.73 76.13 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -57.95 -36.41 55.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 178.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -63.4 -34.03 76.83 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 178.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.623 ' CD2' HD23 ' B' ' 8' ' ' LEU . 42.2 t80 -69.87 -45.38 67.83 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-O 121.155 0.502 . . . . 0.0 110.617 -179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.597 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -82.79 -25.5 32.69 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.87 -179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.406 ' HB2' ' O ' ' A' ' 93' ' ' ILE . 3.4 ttm -84.11 -30.95 25.54 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.111 -0.993 . . . . 0.0 110.017 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -82.91 -27.01 30.94 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.449 -0.782 . . . . 0.0 110.515 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 21.9 ttp -91.69 -17.17 25.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.9 . . . . 0.0 110.579 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 72.4 m -93.14 -27.55 16.85 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.269 -0.894 . . . . 0.0 110.458 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.49 HD23 ' C ' ' A' ' 101' ' ' LEU . 0.3 OUTLIER -59.28 -27.25 65.66 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.41 -0.806 . . . . 0.0 109.754 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . 0.474 ' N ' HD23 ' A' ' 101' ' ' LEU . 0.0 OUTLIER -105.36 -70.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.272 -0.893 . . . . 0.0 110.198 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.9 63.61 1.52 Allowed Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -109.14 73.93 0.88 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.363 -1.081 . . . . 0.0 110.245 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -89.31 -62.41 1.49 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.239 -0.913 . . . . 0.0 110.164 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -133.62 -76.13 0.48 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.367 -0.833 . . . . 0.0 110.242 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.26 27.79 63.43 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -133.1 96.13 3.69 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.273 -1.133 . . . . 0.0 110.235 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -169.19 52.85 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.371 -0.83 . . . . 0.0 109.991 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -151.53 29.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.368 -0.833 . . . . 0.0 110.258 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -165.0 171.11 14.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.383 -0.823 . . . . 0.0 110.124 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.685 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.255 179.943 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.4 ptt? . . . . . 0 N--CA 1.494 1.762 0 CA-C-O 121.31 0.576 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.421 ' OE1' ' CE2' ' B' ' 4' ' ' PHE . 0.7 OUTLIER -114.37 145.24 42.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.481 -0.762 . . . . 0.0 110.136 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.803 HD13 HG21 ' B' ' 17' ' ' VAL . 45.6 pt -137.48 158.77 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.389 -0.819 . . . . 0.0 109.911 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.2 m-85 -112.07 146.42 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.546 -0.722 . . . . 0.0 110.695 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' B' ' 12' ' ' THR . 86.7 t -127.99 122.67 59.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 109.268 179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.2 mmmt -99.88 134.7 42.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.818 . . . . 0.0 110.217 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 34.4 p -95.71 171.98 8.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.393 -0.817 . . . . 0.0 110.531 -179.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.623 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.5 mt -61.67 -12.35 15.89 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.514 -0.741 . . . . 0.0 111.118 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 70.4 p -95.55 -13.01 24.8 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.034 -1.041 . . . . 0.0 110.813 -179.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.5 8.26 38.16 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.181 -1.168 . . . . 0.0 110.181 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 6.9 tttt -84.63 135.17 34.29 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.124 -1.221 . . . . 0.0 109.978 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 7.1 m -113.49 127.61 56.15 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.334 -0.854 . . . . 0.0 110.334 -179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 26.7 mt -109.31 138.64 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.576 HG23 ' CE1' ' B' ' 4' ' ' PHE . 2.6 m -102.15 120.72 40.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.353 -0.842 . . . . 0.0 109.52 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 12.2 mt -123.5 159.98 27.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.179 -0.951 . . . . 0.0 110.886 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.7 113.36 26.81 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.378 -0.827 . . . . 0.0 109.272 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.803 HG21 HD13 ' B' ' 3' ' ' ILE . 34.1 m -140.44 171.81 12.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.127 -0.983 . . . . 0.0 111.276 -179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -112.71 164.48 15.29 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -70.85 -24.44 24.69 Favored 'Trans proline' 0 C--N 1.308 -1.605 0 O-C-N 123.407 1.214 . . . . 0.0 110.484 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.86 -4.32 59.05 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.15 -0.969 . . . . 0.0 110.637 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -71.35 142.96 50.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.115 -0.99 . . . . 0.0 110.767 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.7 p -83.46 159.27 21.78 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.539 -0.726 . . . . 0.0 110.288 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.748 HG23 HD12 ' B' ' 43' ' ' LEU . 50.2 mm -60.01 -34.0 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.34 -0.85 . . . . 0.0 109.54 179.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -61.88 -36.91 82.66 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.364 -0.835 . . . . 0.0 109.461 179.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.22 -33.23 71.43 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.51 -0.744 . . . . 0.0 109.303 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 57.9 t -70.21 -39.36 76.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.363 -0.836 . . . . 0.0 109.282 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.616 ' HE3' HG22 ' B' ' 23' ' ' ILE . 52.4 mttt -63.09 -43.59 98.08 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.461 -0.774 . . . . 0.0 109.116 179.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.33 -33.23 73.26 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.503 -0.748 . . . . 0.0 109.361 179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' B' ' 17' ' ' VAL . 16.8 mttm -68.28 -39.33 82.17 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.53 -0.731 . . . . 0.0 109.55 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 mt -67.26 -39.19 82.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.369 -0.832 . . . . 0.0 109.154 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -60.55 -49.58 76.98 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.413 -0.805 . . . . 0.0 109.489 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -27.7 63.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.39 -0.818 . . . . 0.0 110.412 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -83.99 -41.39 17.33 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.301 -0.874 . . . . 0.0 110.686 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -108.25 -56.55 2.23 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.286 -0.884 . . . . 0.0 110.39 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.67 20.92 1.47 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.291 -1.124 . . . . 0.0 110.291 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.52 HG23 ' HD2' ' B' ' 37' ' ' PRO . 21.2 mt -91.43 144.41 29.64 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.145 -1.209 . . . . 0.0 109.788 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.52 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -67.87 132.09 25.7 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.652 1.343 . . . . 0.0 110.525 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.76 -25.17 80.57 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 O-C-N 123.721 1.38 . . . . 0.0 110.743 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -68.7 -25.06 64.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.22 -0.925 . . . . 0.0 109.819 179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -101.32 2.59 39.84 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.446 -0.784 . . . . 0.0 110.458 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -94.35 135.22 36.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.228 -0.92 . . . . 0.0 110.424 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 3.2 mtp85 -130.18 132.5 46.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.415 -0.803 . . . . 0.0 109.771 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.748 HD12 HG23 ' B' ' 23' ' ' ILE . 15.8 mt -104.79 126.34 51.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.164 -0.96 . . . . 0.0 110.469 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.597 HG21 ' C ' ' A' ' 96' ' ' ALA . 25.9 mm -120.64 131.98 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.606 -0.684 . . . . 0.0 110.105 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.558 ' HB2' HD23 ' B' ' 67' ' ' LEU . 82.4 t80 -141.37 140.43 33.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.311 -0.868 . . . . 0.0 110.125 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.3 33.78 1.31 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.512 -0.742 . . . . 0.0 111.147 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 74.42 6.27 75.33 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 110.335 -1.106 . . . . 0.0 110.335 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -111.61 129.9 55.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.139 -1.212 . . . . 0.0 110.309 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -78.39 131.35 36.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.317 -0.864 . . . . 0.0 109.625 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.626 HD22 ' CG ' ' B' ' 59' ' ' TYR . 12.4 mt -83.96 136.62 34.0 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.165 -0.96 . . . . 0.0 110.166 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -93.69 136.13 34.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.364 -0.835 . . . . 0.0 110.928 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.507 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 8.2 p-10 -48.56 -29.6 4.41 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.523 -0.736 . . . . 0.0 111.324 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.93 -8.53 85.69 Favored Glycine 0 N--CA 1.493 2.463 0 C-N-CA 120.181 -1.009 . . . . 0.0 110.651 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.35 156.66 16.89 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.03 -1.276 . . . . 0.0 110.528 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 64.1 p -102.33 162.09 13.19 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.32 -0.862 . . . . 0.0 110.248 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 84.5 mt -53.59 -41.15 66.29 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.371 -0.831 . . . . 0.0 110.865 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 38.8 p -56.86 -31.73 65.11 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.426 -0.796 . . . . 0.0 111.443 -179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -59.58 -30.52 68.71 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.154 -0.967 . . . . 0.0 110.61 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.626 ' CG ' HD22 ' B' ' 50' ' ' LEU . 94.0 m-85 -101.17 26.29 7.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.233 -0.917 . . . . 0.0 110.286 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 50.62 33.14 7.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.724 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 87.4 mt -81.33 113.27 20.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.361 -0.837 . . . . 0.0 109.817 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -105.65 171.1 7.51 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.342 -0.849 . . . . 0.0 110.301 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 154.39 0.31 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.605 -0.684 . . . . 0.0 111.226 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.0 OUTLIER 62.82 13.81 6.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.769 -0.582 . . . . 0.0 110.936 179.729 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.84 145.82 48.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.205 -0.934 . . . . 0.0 110.074 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.5 m -107.52 113.11 26.21 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.245 -0.909 . . . . 0.0 109.882 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.558 HD23 ' HB2' ' B' ' 45' ' ' PHE . 6.7 mt -102.13 159.84 15.03 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.478 -0.764 . . . . 0.0 109.9 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.446 ' HB2' ' HB ' ' B' ' 44' ' ' ILE . 58.7 m80 -108.51 140.34 41.99 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.328 -0.858 . . . . 0.0 109.534 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 28.0 tp -107.47 133.58 51.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.149 -0.97 . . . . 0.0 110.907 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.646 HG13 ' HB3' ' A' ' 92' ' ' GLN . 98.3 t -124.59 159.29 30.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.554 -0.716 . . . . 0.0 109.627 179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 71' ' ' LEU . 10.1 mt -93.99 125.37 38.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 110.214 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.403 ' HA ' ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -99.0 176.8 5.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.357 -0.839 . . . . 0.0 110.202 -179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 40.3 mt -125.28 151.16 46.35 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.366 -0.834 . . . . 0.0 110.189 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -150.46 73.55 1.14 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.272 -0.893 . . . . 0.0 110.182 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 66.05 33.79 86.45 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.277 0 CA-C-O 117.992 -1.449 . . . . 0.0 109.55 -179.964 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 52.8 p-80 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.169 0.509 . . . . 0.0 110.206 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 9.3 mtp -129.62 173.58 10.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.307 -0.871 . . . . 0.0 110.347 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.47 23.29 14.14 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.398 -0.814 . . . . 0.0 109.568 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.34 74.67 2.49 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -88.04 80.95 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.403 -1.057 . . . . 0.0 110.045 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -156.0 -122.5 0.77 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.537 -1.425 . . . . 0.0 109.537 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.82 92.04 1.52 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.318 -1.107 . . . . 0.0 110.255 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.89 -43.96 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.401 -0.812 . . . . 0.0 110.184 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -80.24 -27.19 38.75 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.41 -0.806 . . . . 0.0 110.193 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.583 ' HD2' HG11 ' A' ' 14' ' ' VAL . 28.8 p90 -169.42 125.4 0.87 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.347 -0.846 . . . . 0.0 110.112 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.65 43.81 0.23 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -0.823 . . . . 0.0 110.308 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -124.63 61.87 1.14 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.296 -0.877 . . . . 0.0 109.999 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.535 ' HA2' HD22 ' A' ' 22' ' ' LEU . . . 124.27 -28.66 5.27 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.583 HG11 ' HD2' ' A' ' 10' ' ' PHE . 11.8 p -69.93 -27.02 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -1.088 . . . . 0.0 110.27 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -134.69 139.77 33.41 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.35 -0.844 . . . . 0.0 110.22 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.66 -12.04 28.61 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.591 1.311 . . . . 0.0 110.804 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -72.92 -7.82 52.79 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.16 -0.962 . . . . 0.0 110.517 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -113.64 12.15 18.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.157 -0.964 . . . . 0.0 110.54 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.48 117.43 0.55 Allowed Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.72 -14.15 32.82 Favored 'Trans proline' 0 C--N 1.307 -1.625 0 O-C-N 123.931 1.49 . . . . 0.0 110.032 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 9.0 tt0 -75.17 -30.11 60.62 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.343 -0.848 . . . . 0.0 109.489 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.535 HD22 ' HA2' ' A' ' 13' ' ' GLY . 2.4 mp -88.97 -27.6 20.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.575 -0.703 . . . . 0.0 109.417 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.13 -41.65 63.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.393 -0.817 . . . . 0.0 109.577 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.797 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -78.07 -32.82 50.98 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.781 . . . . 0.0 109.668 179.587 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -60.5 -43.73 96.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.35 -0.844 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -22.06 54.52 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.383 -0.823 . . . . 0.0 110.118 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -80.45 -29.84 37.52 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.401 -0.812 . . . . 0.0 109.284 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 24' ' ' LEU . 72.3 t -77.46 -29.11 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.58 -0.7 . . . . 0.0 109.812 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.4 t -75.12 -47.95 26.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.39 -0.819 . . . . 0.0 110.092 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 11.9 mmt -62.71 -40.44 97.15 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.388 -0.82 . . . . 0.0 110.035 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.13 -36.87 85.63 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.327 -0.858 . . . . 0.0 110.104 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -62.66 -44.51 96.08 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.413 -0.804 . . . . 0.0 110.0 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -61.29 -31.46 71.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.33 -0.856 . . . . 0.0 110.094 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -43.56 79.68 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.337 -0.852 . . . . 0.0 109.994 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.44 -28.63 69.94 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.387 -0.82 . . . . 0.0 110.044 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.87 -41.92 50.85 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.383 -0.823 . . . . 0.0 110.104 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.2 mt-30 -78.72 -23.76 45.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.141 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -83.99 -60.95 1.94 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.406 -0.809 . . . . 0.0 109.588 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -52.89 -29.93 31.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.417 -0.802 . . . . 0.0 109.321 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -84.47 -37.77 20.96 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.701 -0.625 . . . . 0.0 109.513 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.33 -54.15 15.99 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.222 -0.924 . . . . 0.0 110.033 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -60.11 -35.82 76.07 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.509 -0.744 . . . . 0.0 110.204 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mtp85 -58.52 -45.65 88.39 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.264 -0.898 . . . . 0.0 109.995 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -80.15 -29.86 38.86 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 109.802 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.552 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -65.39 -25.44 67.56 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.414 -0.804 . . . . 0.0 110.041 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.52 -46.07 7.81 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.385 -0.822 . . . . 0.0 110.242 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.76 -29.43 70.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.382 -0.824 . . . . 0.0 110.227 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -90.78 -31.95 16.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.32 -0.863 . . . . 0.0 110.203 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.552 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -67.51 -25.69 65.97 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.322 -0.861 . . . . 0.0 110.171 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.18 -28.25 57.23 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.325 -0.859 . . . . 0.0 110.214 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -113.09 35.47 3.92 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.355 -0.841 . . . . 0.0 110.221 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -166.13 -52.74 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.28 -0.888 . . . . 0.0 110.247 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.22 -21.93 77.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.741 -1.344 . . . . 0.0 109.741 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.7 tp -58.4 -25.58 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.299 -1.118 . . . . 0.0 110.409 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.496 ' O ' HG23 ' A' ' 56' ' ' THR . . . -124.18 74.27 1.29 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.342 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.496 HG23 ' O ' ' A' ' 55' ' ' ALA . 6.3 p -153.64 58.83 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.32 -0.863 . . . . 0.0 110.162 179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 91.7 m -157.52 125.22 5.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.366 -0.834 . . . . 0.0 110.216 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.15 -74.46 0.02 OUTLIER Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.2 p -145.4 69.59 1.24 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.358 -1.083 . . . . 0.0 110.272 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -83.67 60.74 5.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.312 -0.868 . . . . 0.0 110.215 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -82.65 -57.42 3.34 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.182 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.479 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 60.4 m -126.05 89.83 3.09 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.429 -0.795 . . . . 0.0 110.161 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -63.12 -32.27 73.61 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 110.252 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -77.35 -33.1 55.42 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.245 -0.909 . . . . 0.0 109.287 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.479 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -60.2 -37.78 81.31 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.552 -0.859 . . . . 0.0 108.725 179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.45 -31.24 69.43 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.8 tt -73.68 -43.42 59.38 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.458 -0.776 . . . . 0.0 109.75 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -53.17 6.97 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.463 -0.773 . . . . 0.0 110.483 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.2 ttt -53.34 -38.18 63.0 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.078 -1.014 . . . . 0.0 110.521 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.4 m -69.88 -42.41 73.49 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.298 -0.876 . . . . 0.0 110.498 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.9 tp -82.8 -15.92 11.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.098 -1.001 . . . . 0.0 110.234 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 23.1 t -74.77 -35.69 62.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.263 -0.898 . . . . 0.0 109.864 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -87.13 -23.77 24.74 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.464 -0.773 . . . . 0.0 110.201 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -90.32 -36.94 14.37 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.303 -0.873 . . . . 0.0 110.309 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -79.11 -39.75 32.86 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.352 -0.843 . . . . 0.0 110.289 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -92.57 -18.61 22.88 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.385 -0.822 . . . . 0.0 110.595 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.37 -55.49 30.14 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.715 -1.354 . . . . 0.0 109.715 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 -108.91 126.33 52.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.375 -1.074 . . . . 0.0 110.105 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 m -99.19 9.28 43.76 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.402 -0.811 . . . . 0.0 110.567 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.458 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -88.84 57.89 4.05 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.59 ' N ' ' CD ' ' A' ' 82' ' ' PRO . 0.3 OUTLIER -161.47 41.84 0.09 OUTLIER Pre-proline 0 C--N 1.307 -1.279 0 O-C-N 121.424 -1.045 . . . . 0.0 110.274 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' A' ' 81' ' ' LEU . 46.3 Cg_endo -70.05 -10.16 27.7 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 N-CA-C 108.532 -1.372 . . . . 0.0 108.532 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 56.7 101.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.827 -0.546 . . . . 0.0 110.431 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.7 mt -91.08 -38.14 12.97 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.39 -0.819 . . . . 0.0 110.179 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.8 m -70.27 -11.65 61.05 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.315 -0.866 . . . . 0.0 110.562 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.6 m -92.98 -24.83 18.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.158 -0.964 . . . . 0.0 110.297 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.456 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 36.4 mtm -84.19 124.23 30.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.178 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.6 p -78.23 -165.45 0.68 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.459 -0.775 . . . . 0.0 110.591 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.485 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.6 pt-20 -65.75 -31.31 72.23 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.442 -0.786 . . . . 0.0 109.248 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.503 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 46.5 mt-10 -84.64 -41.2 16.58 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 4.3 tp10 -62.74 -45.93 90.45 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 178.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.628 ' HB3' HG13 ' B' ' 70' ' ' VAL . 79.6 mt-30 -65.2 -36.28 83.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.545 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.2 OUTLIER -59.42 -40.09 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 178.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -56.63 -31.83 64.73 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.83 ' CD2' HD23 ' B' ' 8' ' ' LEU . 21.8 t80 -65.46 -36.3 83.48 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.506 0.669 . . . . 0.0 109.289 178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.726 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -83.0 -32.15 27.1 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.648 -0.657 . . . . 0.0 110.171 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.634 ' O ' HD12 ' A' ' 101' ' ' LEU . 7.4 mtt -83.7 -24.21 31.34 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.366 -0.834 . . . . 0.0 110.094 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.409 ' CB ' ' O ' ' A' ' 94' ' ' ALA . 8.3 tp60 -82.28 -36.22 27.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.412 -0.805 . . . . 0.0 110.273 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.445 ' HE2' ' CZ ' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -82.9 -24.18 33.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.301 -0.875 . . . . 0.0 110.312 -179.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 51.6 m -82.26 -28.31 31.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.354 -0.841 . . . . 0.0 110.009 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.634 HD12 ' O ' ' A' ' 97' ' ' MET . 6.5 mt -93.33 15.85 14.67 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 tp60 -107.85 -27.54 10.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.213 -0.93 . . . . 0.0 110.154 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -79.3 -77.62 0.9 Allowed Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.71 75.34 0.84 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.293 -1.121 . . . . 0.0 110.136 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -65.76 -68.19 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.294 -0.879 . . . . 0.0 110.333 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -133.89 -48.21 0.8 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.31 -0.869 . . . . 0.0 110.078 179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 137.47 -104.99 0.48 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -116.19 54.51 0.83 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.326 -1.103 . . . . 0.0 110.214 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.82 79.02 0.12 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.362 -0.836 . . . . 0.0 110.478 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -106.79 50.68 0.76 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.347 -0.845 . . . . 0.0 110.121 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.2 p -68.28 109.92 3.82 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.189 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.226 179.989 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 ptt? . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.334 0.588 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 1.6 tp60 -108.62 147.31 32.04 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.54 -0.725 . . . . 0.0 110.004 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.6 156.14 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.272 -0.893 . . . . 0.0 110.115 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 79.1 m-85 -111.85 144.13 41.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.585 -0.697 . . . . 0.0 110.739 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' B' ' 12' ' ' THR . 60.1 t -128.03 122.28 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.459 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 7.2 mtmt -99.92 131.28 45.98 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.44 -0.788 . . . . 0.0 110.45 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.6 p -95.93 177.4 5.77 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.818 . . . . 0.0 110.417 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.83 HD23 ' CD2' ' A' ' 95' ' ' TYR . 4.2 mt -61.49 -14.77 31.83 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.451 -0.78 . . . . 0.0 110.782 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.3 p -95.69 13.07 27.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.174 -0.954 . . . . 0.0 110.878 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 72.75 9.9 75.65 Favored Glycine 0 N--CA 1.493 2.454 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.459 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.0 tttp -84.54 135.26 34.29 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.09 -1.241 . . . . 0.0 109.876 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.438 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 61.9 m -113.24 131.64 55.83 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.333 -0.854 . . . . 0.0 110.464 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.2 OUTLIER -109.78 140.59 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.388 -0.82 . . . . 0.0 110.185 179.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.715 ' C ' HD12 ' B' ' 15' ' ' LEU . 10.0 m -101.96 121.39 42.05 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.38 -0.825 . . . . 0.0 109.334 179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.715 HD12 ' C ' ' B' ' 14' ' ' THR . 9.5 mp -123.33 156.55 35.11 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.091 -1.005 . . . . 0.0 111.11 -179.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -106.58 108.91 20.65 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.478 179.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.405 HG12 ' CD ' ' B' ' 29' ' ' LYS . 30.1 m -140.45 172.67 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 110.974 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.452 ' O ' HD12 ' B' ' 56' ' ' LEU . 25.4 mt-10 -112.89 168.26 7.97 Favored Pre-proline 0 N--CA 1.489 1.482 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -25.19 19.99 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 O-C-N 123.49 1.258 . . . . 0.0 110.391 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.7 p -84.63 -2.35 57.34 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.103 -0.998 . . . . 0.0 110.464 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.14 142.41 50.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.123 -0.986 . . . . 0.0 110.394 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.9 p -83.03 154.93 24.19 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.559 -0.713 . . . . 0.0 110.505 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.582 HG23 HD12 ' B' ' 43' ' ' LEU . 34.4 mm -59.61 -32.19 48.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.338 -0.851 . . . . 0.0 109.67 179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -62.56 -38.21 89.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.339 -0.851 . . . . 0.0 109.257 179.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.26 -31.6 69.04 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.535 -0.728 . . . . 0.0 109.342 179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.6 t -70.16 -40.93 78.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.46 -0.775 . . . . 0.0 109.111 179.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.523 ' HE2' HG22 ' B' ' 23' ' ' ILE . 14.7 mttm -62.94 -41.17 99.42 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.467 -0.77 . . . . 0.0 109.133 178.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -35.21 76.88 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.498 -0.751 . . . . 0.0 109.202 179.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.405 ' CD ' HG12 ' B' ' 17' ' ' VAL . 15.7 mttp -67.93 -36.15 79.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.486 -0.759 . . . . 0.0 109.208 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.93 -40.03 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.354 -0.841 . . . . 0.0 108.967 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.407 ' O ' ' N ' ' B' ' 35' ' ' GLY . 2.1 tt0 -60.53 -46.25 90.86 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.521 -0.737 . . . . 0.0 109.182 178.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -31.28 67.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.47 -0.769 . . . . 0.0 110.519 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.4 ' CE ' ' HG ' ' B' ' 15' ' ' LEU . 0.6 OUTLIER -83.46 -39.7 20.2 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.16 -0.962 . . . . 0.0 111.126 -179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -108.03 -53.84 2.58 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.263 -0.898 . . . . 0.0 110.592 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 122.59 18.89 3.21 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.541 HG23 ' HD2' ' B' ' 37' ' ' PRO . 90.0 mt -91.32 145.0 30.6 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.117 -1.225 . . . . 0.0 109.803 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.541 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.5 Cg_endo -66.19 131.77 27.79 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 O-C-N 123.646 1.34 . . . . 0.0 110.548 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.74 -25.04 80.27 Favored 'Trans proline' 0 C--N 1.313 -1.33 0 O-C-N 123.723 1.381 . . . . 0.0 110.779 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -68.83 -25.55 64.72 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.372 -0.83 . . . . 0.0 109.866 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' B' ' 72' ' ' ARG . 2.6 mt-30 -101.45 8.77 41.96 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.352 -0.843 . . . . 0.0 110.61 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -94.4 139.53 30.98 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.122 -0.986 . . . . 0.0 110.467 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.545 ' NE ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.31 127.45 39.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.436 -0.79 . . . . 0.0 109.914 179.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.787 ' C ' HD12 ' B' ' 44' ' ' ILE . 13.1 mt -104.85 124.02 48.72 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.227 -0.921 . . . . 0.0 110.377 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.787 HD12 ' C ' ' B' ' 43' ' ' LEU . 2.0 mp -120.96 137.7 53.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.591 -0.693 . . . . 0.0 109.87 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -140.72 132.85 27.98 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.364 -0.835 . . . . 0.0 109.715 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.78 28.56 0.58 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.399 -0.813 . . . . 0.0 111.109 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 101' ' ' LEU . . . 85.52 7.14 82.63 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.59 -1.004 . . . . 0.0 110.59 179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.3 mttm -111.29 125.01 53.38 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.025 -1.28 . . . . 0.0 110.654 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -78.26 133.53 37.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 109.099 179.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.734 HD22 ' CD2' ' B' ' 59' ' ' TYR . 19.0 mt -84.06 140.87 31.55 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.271 -0.893 . . . . 0.0 110.663 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -93.63 129.91 39.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.492 -0.755 . . . . 0.0 110.25 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.458 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 6.7 p-10 -48.5 -26.79 2.33 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.414 -0.803 . . . . 0.0 111.287 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -9.72 83.83 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 2.6 mpt_? -99.42 159.24 15.16 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.027 -1.278 . . . . 0.0 110.51 -179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 25.2 p -102.08 165.26 11.25 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.172 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.569 ' HA ' HD12 ' B' ' 61' ' ' ILE . 90.8 mt -53.61 -45.43 70.05 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.32 -0.862 . . . . 0.0 110.77 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.9 t -56.91 -33.47 66.97 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.398 -0.814 . . . . 0.0 111.139 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -59.58 -29.2 67.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.116 -0.99 . . . . 0.0 110.293 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.734 ' CD2' HD22 ' B' ' 50' ' ' LEU . 64.8 m-85 -101.31 28.37 5.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 50.78 29.6 4.41 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.556 -0.715 . . . . 0.0 110.538 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.569 HD12 ' HA ' ' B' ' 56' ' ' LEU . 94.6 mt -81.5 108.58 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.337 -0.852 . . . . 0.0 109.977 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -105.66 172.84 6.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.373 -0.829 . . . . 0.0 110.095 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.6 pttt -46.5 154.03 0.32 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.518 -0.739 . . . . 0.0 111.053 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 0.5 OUTLIER 62.83 14.11 7.1 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.67 -0.643 . . . . 0.0 110.799 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 138.48 48.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.069 -1.019 . . . . 0.0 109.995 179.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 27.6 m -107.32 109.87 21.74 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.284 -0.885 . . . . 0.0 110.111 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.41 HD21 HD13 ' B' ' 61' ' ' ILE . 1.0 OUTLIER -102.49 164.3 11.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.351 -0.843 . . . . 0.0 109.943 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -108.98 137.68 46.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 109.673 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 59.3 tp -107.01 131.42 54.08 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.334 -0.854 . . . . 0.0 110.619 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.628 HG13 ' HB3' ' A' ' 92' ' ' GLN . 35.3 t -124.87 153.21 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.49 -0.757 . . . . 0.0 109.896 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' B' ' 71' ' ' LEU . 12.7 mt -94.07 117.03 29.52 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.259 -0.901 . . . . 0.0 110.311 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 18.5 ttt-85 -90.26 100.56 13.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.279 -0.888 . . . . 0.0 110.157 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mp -71.33 -173.07 0.82 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -164.6 95.9 0.74 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.287 -0.883 . . . . 0.0 110.312 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.32 -65.86 3.0 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 CA-C-O 117.996 -1.447 . . . . 0.0 109.579 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.146 0.498 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.8 mtp -60.86 -178.42 0.1 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.428 -0.795 . . . . 0.0 110.259 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.72 23.62 13.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.504 -0.748 . . . . 0.0 109.56 179.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.3 -8.18 78.49 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.7 -33.32 66.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.121 -1.223 . . . . 0.0 110.269 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -96.37 130.86 10.41 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -89.34 10.46 22.29 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.446 -1.032 . . . . 0.0 110.545 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 p -113.16 -18.58 12.09 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.235 -0.916 . . . . 0.0 110.296 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -57.74 -24.04 55.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.262 -0.899 . . . . 0.0 110.43 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.449 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 31.1 p90 -160.8 119.55 2.56 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.273 -0.892 . . . . 0.0 110.314 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -134.27 66.83 1.53 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.475 -0.765 . . . . 0.0 110.032 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 52.65 36.56 21.18 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.291 -0.88 . . . . 0.0 110.428 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -138.79 17.12 3.26 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.571 -1.411 . . . . 0.0 109.571 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.5 p -129.53 -26.45 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -1.091 . . . . 0.0 110.592 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.555 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -56.48 -178.7 0.07 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.293 -0.88 . . . . 0.0 110.277 -179.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.804 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 37.2 Cg_endo -62.01 79.91 0.09 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.601 1.316 . . . . 0.0 110.497 -178.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 70.1 45.98 0.66 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -179.321 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 43.51 27.62 0.16 Allowed 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.145 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -161.43 105.33 1.21 Allowed Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 121.087 -1.008 . . . . 0.0 110.54 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -73.32 -13.59 25.47 Favored 'Trans proline' 0 C--N 1.305 -1.74 0 O-C-N 124.144 1.602 . . . . 0.0 109.58 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 7.4 tt0 -75.15 -30.43 60.76 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.559 -0.713 . . . . 0.0 109.495 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.4 mt -84.97 -27.7 26.32 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.804 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -75.72 -41.34 53.79 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.489 -0.757 . . . . 0.0 109.794 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.7 mm? -78.87 -33.01 46.12 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.508 -0.745 . . . . 0.0 110.025 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -64.9 -38.47 91.08 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.405 -0.809 . . . . 0.0 109.994 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.11 -21.53 43.15 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 110.404 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.81 -29.74 35.97 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.279 -0.888 . . . . 0.0 109.268 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 24' ' ' LEU . 73.5 t -78.88 -31.95 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 C-N-CA 120.076 -0.65 . . . . 0.0 109.71 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.7 m -74.99 -39.38 61.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.458 -0.776 . . . . 0.0 110.037 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 5.5 tpt -67.32 -42.92 82.84 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.386 -0.821 . . . . 0.0 109.998 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -62.09 -34.32 76.09 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.4 -0.813 . . . . 0.0 110.035 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -68.1 -41.58 81.61 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.82 -34.86 76.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.361 -0.837 . . . . 0.0 109.972 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.7 -45.23 62.52 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.389 -0.819 . . . . 0.0 110.093 179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -62.93 -40.45 97.66 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.175 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.2 -39.56 94.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.365 -0.834 . . . . 0.0 110.193 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.581 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 32.2 mm-40 -78.39 -27.57 46.8 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.402 -0.811 . . . . 0.0 110.158 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -84.15 -60.06 2.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.42 -0.8 . . . . 0.0 109.608 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -51.43 -30.49 19.57 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.493 -0.754 . . . . 0.0 109.328 179.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -85.67 -37.24 19.66 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.663 -0.648 . . . . 0.0 109.499 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -68.55 -54.6 15.63 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.615 -0.834 . . . . 0.0 109.963 179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 33.7 mtt85 -60.67 -37.32 81.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.473 -0.767 . . . . 0.0 110.255 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -40.27 75.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.308 -0.87 . . . . 0.0 109.94 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.68 -28.43 62.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.396 -0.815 . . . . 0.0 109.748 179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.541 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -78.13 -26.78 48.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.472 -0.767 . . . . 0.0 110.046 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.96 -38.44 22.73 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.37 -0.831 . . . . 0.0 110.188 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.23 -40.1 82.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.327 -0.858 . . . . 0.0 110.134 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 m -79.59 -28.68 41.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.329 -0.857 . . . . 0.0 110.165 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -69.14 -24.68 64.12 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.422 -0.799 . . . . 0.0 110.229 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.33 -28.93 24.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.308 -0.87 . . . . 0.0 110.161 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -87.6 100.22 12.63 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.384 -0.822 . . . . 0.0 110.274 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.38 32.32 13.61 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.364 -0.835 . . . . 0.0 110.516 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -122.39 -37.18 0.65 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.634 HG23 ' O ' ' A' ' 54' ' ' ILE . 11.3 tt -66.87 79.13 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -1.071 . . . . 0.0 110.267 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -115.55 132.01 56.76 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.254 -0.904 . . . . 0.0 110.197 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 16.5 p -76.2 -172.04 1.93 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.404 -0.81 . . . . 0.0 110.252 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.6 p -74.65 103.2 4.85 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.327 -0.858 . . . . 0.0 110.198 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.88 -112.17 1.08 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.3 m -154.45 74.67 0.96 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.272 -1.134 . . . . 0.0 110.301 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -139.77 43.7 1.96 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.174 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -103.51 -42.64 5.62 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.529 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 6.5 m -102.93 70.1 1.07 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.427 -0.796 . . . . 0.0 110.161 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -77.68 -60.72 2.25 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.267 -0.895 . . . . 0.0 110.184 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.81 -29.16 62.0 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.215 -0.928 . . . . 0.0 109.075 179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.529 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -59.75 -50.24 74.59 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.787 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.06 -31.12 68.58 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 108.677 -0.861 . . . . 0.0 108.677 178.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.9 tt -75.41 -33.62 60.98 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.509 -0.744 . . . . 0.0 109.377 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 mmtm -80.38 -58.13 3.27 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.581 -0.699 . . . . 0.0 110.293 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -53.29 -30.8 40.69 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.329 -0.857 . . . . 0.0 110.82 -179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.9 m -74.28 -44.15 53.96 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.343 -0.848 . . . . 0.0 110.194 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.406 HD12 ' HA ' ' A' ' 71' ' ' ILE . 5.6 tp -81.22 -18.59 11.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.141 -0.974 . . . . 0.0 109.952 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.8 t -72.28 -41.37 66.76 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.41 -0.806 . . . . 0.0 109.502 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -26.49 50.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.582 -0.699 . . . . 0.0 109.831 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -84.97 -42.21 15.14 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.375 -0.828 . . . . 0.0 110.28 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' CG ' ' N ' ' A' ' 76' ' ' PHE . 15.0 pt-20 -64.15 -37.98 89.41 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.256 -0.903 . . . . 0.0 110.09 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.416 ' N ' ' CG ' ' A' ' 75' ' ' GLU . 61.8 t80 -82.56 -29.62 30.19 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.462 -0.774 . . . . 0.0 110.188 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -67.8 -35.21 84.76 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.636 -1.385 . . . . 0.0 109.636 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.3 mtt180 -105.9 -24.0 12.55 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -1.098 . . . . 0.0 110.445 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.658 HG22 ' O ' ' A' ' 79' ' ' THR . 96.5 m 52.33 25.66 3.58 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.239 -0.913 . . . . 0.0 110.136 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.485 ' O ' HD23 ' A' ' 81' ' ' LEU . . . 99.97 -92.53 1.13 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 80' ' ' GLY . 95.6 mt -153.08 143.27 15.38 Favored Pre-proline 0 N--CA 1.487 1.397 0 O-C-N 121.582 -0.952 . . . . 0.0 108.456 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -75.84 50.15 2.69 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 O-C-N 123.512 1.27 . . . . 0.0 110.359 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -59.04 119.43 7.26 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 110.24 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.428 HD22 HD13 ' B' ' 8' ' ' LEU . 43.9 mt -80.05 -29.32 39.21 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.385 -0.822 . . . . 0.0 110.155 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.1 t -61.26 -32.22 72.03 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -0.826 . . . . 0.0 110.132 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.5 m -84.1 -27.94 27.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.286 -0.884 . . . . 0.0 109.998 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.6 mtt -81.24 119.18 23.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.449 -0.782 . . . . 0.0 110.008 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.442 ' N ' ' HB2' ' A' ' 91' ' ' GLU . 75.6 p -74.55 -168.08 0.64 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.467 -0.771 . . . . 0.0 110.382 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.559 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -67.11 -28.34 68.08 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.529 -0.732 . . . . 0.0 109.237 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.493 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.7 mt-10 -85.4 -41.75 15.15 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.442 ' HB2' ' N ' ' A' ' 88' ' ' THR . 5.1 mm-40 -63.73 -42.96 97.8 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.609 ' HB3' HG13 ' B' ' 70' ' ' VAL . 39.5 mt-30 -68.52 -33.8 74.76 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.559 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.45 -40.27 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.26 -33.56 67.72 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 178.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.789 ' CD2' HD23 ' B' ' 8' ' ' LEU . 22.4 t80 -62.02 -44.04 97.55 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.623 0.725 . . . . 0.0 109.365 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.625 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -76.58 -33.16 58.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.757 -0.59 . . . . 0.0 110.376 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.401 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 55.5 mtt -79.27 -23.24 43.76 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.313 -0.867 . . . . 0.0 109.661 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -81.84 -26.53 34.2 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.471 -0.768 . . . . 0.0 110.177 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.483 ' HE2' ' CE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -94.11 -21.77 18.91 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.354 -0.841 . . . . 0.0 110.34 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 67.3 m -87.1 -23.32 24.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.401 -0.812 . . . . 0.0 110.147 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.566 HD13 ' HA3' ' B' ' 47' ' ' GLY . 7.5 tp -86.87 8.88 21.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.367 -0.833 . . . . 0.0 110.523 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.07 34.95 1.73 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.266 -0.896 . . . . 0.0 110.164 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.64 74.63 0.38 Allowed Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.555 -1.418 . . . . 0.0 109.555 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -155.8 93.86 1.5 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.37 -1.077 . . . . 0.0 110.335 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -107.92 -50.17 3.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.327 -0.858 . . . . 0.0 110.124 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 60.59 38.97 18.43 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.398 -0.814 . . . . 0.0 109.95 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -60.72 120.84 24.53 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.612 -1.395 . . . . 0.0 109.612 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -102.85 88.3 3.16 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.377 -1.072 . . . . 0.0 110.276 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -170.54 123.25 0.65 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.321 -0.862 . . . . 0.0 110.233 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -64.53 -39.02 92.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.35 -0.844 . . . . 0.0 110.127 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -153.94 -58.04 0.12 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.285 -0.884 . . . . 0.0 110.264 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.207 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.469 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 46.8 ttp . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.186 0.517 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -90.05 138.94 31.09 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.377 -0.827 . . . . 0.0 109.83 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 22.0 pt -137.4 160.88 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.284 -0.885 . . . . 0.0 110.476 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.694 ' CE1' HG23 ' B' ' 14' ' ' THR . 68.4 m-85 -111.66 142.58 43.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.725 -0.609 . . . . 0.0 110.536 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 77.1 t -127.75 119.76 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.497 -0.752 . . . . 0.0 109.652 179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.705 ' HG3' HG23 ' B' ' 12' ' ' THR . 0.1 OUTLIER -100.2 130.07 46.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.401 -0.812 . . . . 0.0 110.665 -179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 47.6 p -96.15 175.8 6.32 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.54 -0.725 . . . . 0.0 110.166 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.789 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.3 mt -61.71 -14.07 28.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.437 -0.789 . . . . 0.0 110.964 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.2 p -95.71 19.11 11.71 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.102 -0.999 . . . . 0.0 110.642 -179.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.49 12.43 58.76 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.449 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.9 tttt -84.92 129.88 34.73 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.072 -1.252 . . . . 0.0 109.829 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.705 HG23 ' HG3' ' B' ' 6' ' ' LYS . 1.1 m -113.09 123.91 51.36 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.282 -0.886 . . . . 0.0 110.263 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.7 mt -109.27 136.7 44.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.458 -0.776 . . . . 0.0 110.367 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.694 HG23 ' CE1' ' B' ' 4' ' ' PHE . 3.5 m -102.1 119.99 39.7 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.406 -0.809 . . . . 0.0 109.475 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 90.0 mt -123.49 162.58 22.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 110.87 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -106.5 116.63 32.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.394 -0.817 . . . . 0.0 109.575 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' B' ' 1' ' ' MET . 34.1 m -140.25 176.78 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.254 -0.904 . . . . 0.0 110.772 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.476 ' O ' HD12 ' B' ' 56' ' ' LEU . 16.5 mm-40 -113.22 165.53 13.07 Favored Pre-proline 0 N--CA 1.489 1.483 0 O-C-N 121.551 -0.718 . . . . 0.0 109.17 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.93 -27.79 13.95 Favored 'Trans proline' 0 C--N 1.307 -1.605 0 O-C-N 123.456 1.24 . . . . 0.0 110.424 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.7 t -84.55 -1.62 56.13 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.247 -0.908 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -70.99 142.25 50.99 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.17 -0.956 . . . . 0.0 110.166 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 74.5 p -82.97 159.61 22.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.605 -0.685 . . . . 0.0 110.49 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.595 HG23 HD12 ' B' ' 43' ' ' LEU . 47.4 mm -59.83 -36.68 67.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 O-C-N 121.382 -0.824 . . . . 0.0 109.605 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -61.21 -35.43 77.16 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.862 . . . . 0.0 109.379 179.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.38 -34.13 72.22 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.484 -0.76 . . . . 0.0 109.538 179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.97 -39.6 77.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.38 -0.825 . . . . 0.0 109.185 179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -63.03 -41.72 99.59 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.52 -0.737 . . . . 0.0 109.051 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.71 -34.06 75.13 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.468 -0.77 . . . . 0.0 109.366 179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.416 ' CD ' HG12 ' B' ' 17' ' ' VAL . 0.4 OUTLIER -68.29 -39.78 82.0 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.465 -0.772 . . . . 0.0 109.541 179.452 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 mt -67.2 -38.19 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.114 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -60.94 -52.46 64.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.528 -0.732 . . . . 0.0 109.727 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -57.92 -26.37 62.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.396 -0.815 . . . . 0.0 110.517 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -83.86 -39.97 19.23 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.294 -0.878 . . . . 0.0 110.564 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -108.12 -58.67 1.95 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.248 -0.907 . . . . 0.0 110.351 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.39 18.03 1.34 Allowed Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.953 -1.117 . . . . 0.0 110.433 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.503 HG23 ' HD2' ' B' ' 37' ' ' PRO . 42.7 mt -91.33 144.05 29.17 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.028 -1.277 . . . . 0.0 109.851 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.0 Cg_endo -68.1 132.01 25.11 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 O-C-N 123.728 1.383 . . . . 0.0 110.423 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.78 -26.05 82.29 Favored 'Trans proline' 0 C--N 1.313 -1.319 0 O-C-N 123.692 1.364 . . . . 0.0 110.824 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 56.8 m-20 -68.84 -23.7 64.27 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.374 -0.829 . . . . 0.0 109.971 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.409 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 18.7 mt-30 -101.31 1.2 38.43 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.326 -0.859 . . . . 0.0 110.442 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -94.33 138.61 32.1 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.532 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.437 ' HB2' ' HB ' ' B' ' 70' ' ' VAL . 0.5 OUTLIER -130.15 131.45 45.66 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.489 -0.757 . . . . 0.0 109.726 179.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.9 mt -104.89 127.33 52.68 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.174 -0.954 . . . . 0.0 110.708 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.802 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.27 133.17 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.557 -0.715 . . . . 0.0 109.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.643 ' HB2' HD23 ' B' ' 67' ' ' LEU . 73.4 t80 -141.14 145.58 35.92 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.505 -0.747 . . . . 0.0 110.012 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.09 27.52 0.31 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.524 -0.735 . . . . 0.0 111.568 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.566 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 82.41 -2.76 84.33 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 120.128 -1.034 . . . . 0.0 110.705 179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 ttpt -110.73 137.94 47.76 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.96 -1.318 . . . . 0.0 110.111 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -78.04 140.58 39.13 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.336 -0.852 . . . . 0.0 109.832 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 34.6 mt -84.11 141.0 31.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.273 -0.892 . . . . 0.0 110.369 -179.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -93.75 130.84 39.59 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 0.0 110.594 -179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.523 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.5 m-20 -48.32 -31.33 5.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.489 -0.757 . . . . 0.0 111.222 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.85 -6.49 88.37 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 110.6 -1.0 . . . . 0.0 110.6 -179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 38.3 mmt-85 -99.56 156.8 16.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.036 -1.273 . . . . 0.0 110.413 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.5 p -102.55 165.87 10.85 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.327 -0.858 . . . . 0.0 110.431 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.581 ' HA ' HD12 ' B' ' 61' ' ' ILE . 77.3 mt -53.72 -48.16 69.88 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.459 -0.776 . . . . 0.0 111.004 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.52 -33.57 66.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.323 -0.861 . . . . 0.0 111.051 -179.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -59.62 -28.74 67.46 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.159 -0.963 . . . . 0.0 110.358 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.598 ' CD2' HD22 ' B' ' 50' ' ' LEU . 59.9 m-85 -101.36 29.45 4.76 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.347 -0.845 . . . . 0.0 109.814 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 50.88 28.43 3.72 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.583 -0.698 . . . . 0.0 110.703 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.581 HD12 ' HA ' ' B' ' 56' ' ' LEU . 93.0 mt -81.48 110.37 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.277 -0.889 . . . . 0.0 109.948 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -105.7 172.82 6.6 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.405 -0.809 . . . . 0.0 110.231 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.454 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 1.3 ptpt -46.49 153.6 0.35 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.56 -0.713 . . . . 0.0 111.045 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 63.03 14.92 8.0 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.782 -0.573 . . . . 0.0 110.815 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.67 140.46 49.66 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.234 -0.917 . . . . 0.0 110.108 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.31 111.53 23.93 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.264 -0.897 . . . . 0.0 110.027 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.643 HD23 ' HB2' ' B' ' 45' ' ' PHE . 3.0 mt -102.49 160.52 14.48 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.31 -0.869 . . . . 0.0 110.277 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -108.9 140.61 42.14 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.282 -0.886 . . . . 0.0 110.006 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.665 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.8 tt -107.84 134.77 50.31 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.041 -1.037 . . . . 0.0 110.827 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.665 ' N ' HD23 ' B' ' 69' ' ' LEU . 22.3 t -125.25 151.82 31.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.378 -0.826 . . . . 0.0 109.865 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 92.4 mt -94.11 136.53 34.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.423 -0.798 . . . . 0.0 110.165 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -125.64 146.0 49.91 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.359 -0.838 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 9.9 mt -80.99 162.31 23.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.362 -0.836 . . . . 0.0 110.129 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.97 76.23 10.29 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.411 -0.806 . . . . 0.0 110.19 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 167.24 -86.83 0.1 OUTLIER Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.403 0 CA-C-O 117.956 -1.469 . . . . 0.0 109.559 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 4.8 m80 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.157 0.503 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.519 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.2 mtp -165.55 -178.64 5.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.386 -0.821 . . . . 0.0 110.141 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.552 HD12 ' N ' ' A' ' 3' ' ' LEU . 7.3 mp -112.27 24.28 12.74 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.465 -0.772 . . . . 0.0 109.621 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -84.94 67.67 3.64 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.78 -34.97 30.08 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.366 -1.079 . . . . 0.0 110.148 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -148.65 174.83 28.18 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.6 32.86 2.17 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.418 -1.048 . . . . 0.0 110.164 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 60.7 p -100.39 18.16 19.66 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.347 -0.845 . . . . 0.0 110.344 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.2 -22.88 35.74 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.256 -0.902 . . . . 0.0 110.194 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.787 ' HB2' HG21 ' A' ' 14' ' ' VAL . 37.4 p90 -166.68 121.47 1.11 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.421 -0.799 . . . . 0.0 110.098 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -170.43 50.33 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.255 -0.903 . . . . 0.0 110.688 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.785 ' O ' ' HB2' ' A' ' 18' ' ' ALA . 53.5 p90 -153.45 -39.81 0.1 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.242 -0.911 . . . . 0.0 110.471 179.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.492 ' N ' ' CD1' ' A' ' 12' ' ' PHE . . . -131.01 34.6 2.6 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.787 HG21 ' HB2' ' A' ' 10' ' ' PHE . 54.1 t -110.36 -50.59 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.412 -1.052 . . . . 0.0 110.311 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.547 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.5 OUTLIER -64.99 178.7 0.47 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.849 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.812 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.4 Cg_endo -59.85 77.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.702 1.37 . . . . 0.0 111.23 -178.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 67.88 45.17 1.43 Allowed 'General case' 0 N--CA 1.495 1.808 0 CA-C-O 121.728 0.775 . . . . 0.0 108.945 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.785 ' HB2' ' O ' ' A' ' 12' ' ' PHE . . . 40.23 31.14 0.09 Allowed 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.127 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -160.28 111.51 1.39 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.294 -0.879 . . . . 0.0 110.478 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -72.18 -13.1 28.34 Favored 'Trans proline' 0 C--N 1.308 -1.599 0 O-C-N 123.989 1.521 . . . . 0.0 109.816 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -71.86 -30.74 65.75 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.434 179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 mt -88.87 -29.95 19.27 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.634 -0.666 . . . . 0.0 109.205 179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.812 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -66.27 -41.25 90.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.523 -0.735 . . . . 0.0 109.6 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.645 ' O ' HG23 ' A' ' 28' ' ' VAL . 55.4 mt -78.57 -30.78 46.96 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.458 -0.776 . . . . 0.0 109.801 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.84 -37.82 88.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.42 -0.8 . . . . 0.0 109.853 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.447 ' O ' HD23 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -81.26 -21.48 39.38 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.433 -0.792 . . . . 0.0 110.244 179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -80.47 -33.6 36.55 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.251 -0.906 . . . . 0.0 109.071 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 24' ' ' LEU . 78.3 t -76.37 -29.58 19.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 O-C-N 121.582 -0.699 . . . . 0.0 109.623 179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.0 t -75.43 -41.08 56.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.453 -0.78 . . . . 0.0 109.986 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.6 ttt -62.76 -45.01 94.68 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.425 -0.797 . . . . 0.0 109.951 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -61.9 -38.26 87.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.358 -0.839 . . . . 0.0 109.914 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -63.65 -37.57 87.86 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.421 -0.8 . . . . 0.0 109.905 179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -43.03 99.21 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.423 -0.798 . . . . 0.0 109.955 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -62.72 -37.77 87.85 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.331 -0.856 . . . . 0.0 110.034 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -60.9 -44.11 97.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.389 -0.819 . . . . 0.0 110.06 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -70.43 -37.69 74.43 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.397 -0.814 . . . . 0.0 110.059 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.642 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.4 OUTLIER -72.14 -25.77 61.85 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.353 -0.842 . . . . 0.0 110.044 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.98 -56.98 3.38 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.452 -0.78 . . . . 0.0 109.546 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -52.23 -31.51 32.51 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.489 -0.757 . . . . 0.0 109.272 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -85.61 -34.92 21.28 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.642 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -63.35 -50.12 71.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.427 -0.795 . . . . 0.0 109.564 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 34.5 ptt180 -67.45 -31.33 71.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.503 -0.748 . . . . 0.0 109.551 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.87 -39.62 65.85 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.393 -0.817 . . . . 0.0 109.107 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -76.42 -26.72 55.8 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.23 -27.7 63.66 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.527 -0.733 . . . . 0.0 109.797 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.96 -40.88 13.54 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.36 -0.837 . . . . 0.0 110.191 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.87 -30.94 71.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.092 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -39.52 19.15 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.354 -0.841 . . . . 0.0 110.11 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -75.9 -27.69 57.79 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.42 -0.8 . . . . 0.0 110.138 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.03 -10.85 59.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.357 -0.84 . . . . 0.0 110.537 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -95.69 76.07 3.23 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.185 -0.947 . . . . 0.0 110.28 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.32 25.98 3.77 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.388 -0.82 . . . . 0.0 110.535 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.41 21.96 4.23 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 5.4 tp -78.24 -31.47 16.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.267 -1.137 . . . . 0.0 110.329 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -96.06 -59.24 1.89 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.349 -0.844 . . . . 0.0 110.103 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 37.2 p -134.28 179.96 5.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.371 -0.83 . . . . 0.0 110.195 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.0 p -100.07 128.62 46.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.306 -0.871 . . . . 0.0 110.168 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -145.74 70.2 0.37 Allowed Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 1.3 p -71.8 69.87 0.69 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.37 -1.076 . . . . 0.0 110.178 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -107.66 52.08 0.72 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.848 . . . . 0.0 110.23 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -98.31 -32.5 11.5 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.371 -0.831 . . . . 0.0 110.254 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.4 OUTLIER -106.81 77.61 1.19 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.339 -0.851 . . . . 0.0 110.248 179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -77.81 -58.34 3.32 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.359 -0.838 . . . . 0.0 110.269 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.38 -27.05 60.48 Favored 'General case' 0 N--CA 1.487 1.386 0 O-C-N 121.217 -0.927 . . . . 0.0 109.237 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -63.32 -40.72 98.12 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 119.577 -0.849 . . . . 0.0 108.828 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 10.7 tp -68.25 -28.42 67.2 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.8 tt -78.36 -38.49 41.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.45 -0.781 . . . . 0.0 109.815 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -83.37 -52.58 6.42 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.797 . . . . 0.0 110.414 -179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 14.8 ttt -56.2 -44.61 79.62 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.218 -0.926 . . . . 0.0 110.626 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.3 m -67.44 -39.76 85.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.273 -0.892 . . . . 0.0 110.766 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.7 tp -83.53 -17.01 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.131 -0.98 . . . . 0.0 110.359 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.1 m -72.3 -44.56 62.54 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.288 -0.883 . . . . 0.0 109.72 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.11 -28.48 39.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.503 -0.748 . . . . 0.0 109.935 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -78.36 -46.65 19.46 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.479 -0.763 . . . . 0.0 110.036 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -64.67 -39.27 93.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.432 -0.793 . . . . 0.0 109.965 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.5 t80 53.75 -92.3 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.474 -0.766 . . . . 0.0 110.51 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.1 37.69 86.91 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.785 -1.326 . . . . 0.0 109.785 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 57.35 103.37 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -1.047 . . . . 0.0 110.392 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.1 m -145.81 40.49 1.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.371 -0.831 . . . . 0.0 110.264 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.675 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -83.39 57.21 5.07 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.675 HD12 ' C ' ' A' ' 80' ' ' GLY . 1.6 mp -157.79 149.44 17.05 Favored Pre-proline 0 N--CA 1.485 1.295 0 O-C-N 121.43 -1.041 . . . . 0.0 108.511 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -77.57 35.72 0.52 Allowed 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.438 1.23 . . . . 0.0 110.975 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 50.76 63.38 2.25 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.067 -1.021 . . . . 0.0 110.677 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' B' ' 8' ' ' LEU . 9.2 mt -67.16 -47.65 70.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.414 -0.804 . . . . 0.0 110.199 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.52 -3.05 28.56 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 110.683 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -111.84 -3.84 14.79 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.167 -0.958 . . . . 0.0 110.283 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 11.9 mtm -85.18 -164.55 1.01 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.243 -0.91 . . . . 0.0 109.96 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.8 p -127.74 -179.81 5.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.308 -0.87 . . . . 0.0 110.518 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.618 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 10.5 pt-20 -65.72 -29.72 70.28 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.567 -0.708 . . . . 0.0 109.268 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.505 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 8.3 mt-10 -82.5 -42.33 18.57 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -43.02 99.88 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.479 ' HB3' HG13 ' B' ' 70' ' ' VAL . 32.8 mt-30 -70.02 -33.99 72.72 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.618 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.4 -41.0 90.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 178.213 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.422 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -57.81 -31.52 66.68 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.747 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.6 t80 -62.15 -58.96 5.85 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.353 0.597 . . . . 0.0 109.829 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.532 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -67.75 -32.3 72.8 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.365 -0.835 . . . . 0.0 110.151 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 28.2 mtp -74.89 -20.56 59.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -79.62 -28.4 40.94 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.515 -0.741 . . . . 0.0 109.988 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 61.2 mtm -102.98 0.87 32.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.45 -0.781 . . . . 0.0 110.629 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 10.8 t -112.81 -17.13 12.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.178 -0.951 . . . . 0.0 110.498 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.662 HD22 ' HA3' ' B' ' 47' ' ' GLY . 0.1 OUTLIER -59.46 -26.14 64.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 110.311 179.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -69.75 -57.36 5.21 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.422 -0.799 . . . . 0.0 110.145 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 100.69 114.53 3.73 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -116.47 92.7 3.95 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.43 -1.041 . . . . 0.0 110.163 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -80.0 -56.0 4.56 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.425 -0.797 . . . . 0.0 110.241 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -163.02 -44.36 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.361 -0.837 . . . . 0.0 110.187 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 105.06 54.74 0.75 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -69.82 74.66 0.44 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.353 -1.087 . . . . 0.0 110.203 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.24 88.38 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.296 -0.878 . . . . 0.0 110.465 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -122.47 -56.56 1.79 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.29 -0.881 . . . . 0.0 110.276 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 11.2 t -100.07 56.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.371 -0.831 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.189 -179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.564 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.817 0 CA-C-O 121.363 0.602 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -97.0 151.6 19.55 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.561 -0.712 . . . . 0.0 109.736 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.449 HD13 HG21 ' B' ' 17' ' ' VAL . 22.9 pt -137.52 156.78 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.295 -0.878 . . . . 0.0 110.01 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.4 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 68.0 m-85 -111.75 145.1 39.94 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 90.8 t -128.25 127.49 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.388 -0.82 . . . . 0.0 109.765 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.456 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.5 mttm -100.57 129.52 46.51 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.395 -0.815 . . . . 0.0 110.434 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.567 HG22 HD23 ' B' ' 69' ' ' LEU . 2.0 p -95.73 176.85 5.99 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.349 -0.845 . . . . 0.0 110.289 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.747 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.8 mt -61.16 -16.92 49.76 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.419 -0.801 . . . . 0.0 110.78 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 21.35 8.78 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.189 -0.945 . . . . 0.0 110.58 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 63.42 15.99 57.78 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 1.6 tttm -84.86 137.61 33.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.119 -1.224 . . . . 0.0 109.893 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 11.4 m -113.07 126.92 56.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.247 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.1 OUTLIER -109.88 140.0 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.294 -0.879 . . . . 0.0 110.172 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.774 ' C ' HD12 ' B' ' 15' ' ' LEU . 20.2 m -101.8 121.73 42.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.423 -0.798 . . . . 0.0 109.485 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.774 HD12 ' C ' ' B' ' 14' ' ' THR . 10.4 mp -123.4 159.76 28.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.2 -0.938 . . . . 0.0 110.965 -179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -106.51 113.93 27.74 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.386 -0.821 . . . . 0.0 109.245 179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.564 HG23 ' SD ' ' B' ' 1' ' ' MET . 21.1 m -140.44 173.52 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.198 -0.939 . . . . 0.0 111.079 -178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.423 ' O ' HD22 ' B' ' 56' ' ' LEU . 0.7 OUTLIER -113.11 163.32 18.4 Favored Pre-proline 0 N--CA 1.487 1.417 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 178.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.65 -26.79 15.93 Favored 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 123.527 1.277 . . . . 0.0 110.205 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.4 p -84.61 -2.13 57.0 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.227 -0.92 . . . . 0.0 110.337 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.445 ' O ' HD13 ' B' ' 56' ' ' LEU . 23.0 m-20 -71.33 145.55 49.39 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.243 -0.91 . . . . 0.0 110.573 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 61.4 p -83.94 156.64 22.25 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.524 -0.735 . . . . 0.0 110.212 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.8 mm -59.92 -33.8 54.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.314 -0.866 . . . . 0.0 109.601 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -63.6 -35.45 80.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.417 -0.802 . . . . 0.0 109.467 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -70.02 -34.55 73.42 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.523 -0.736 . . . . 0.0 109.095 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.79 HG21 HD11 ' B' ' 56' ' ' LEU . 97.3 t -70.07 -36.29 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.737 -0.785 . . . . 0.0 109.042 179.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -63.13 -43.76 97.49 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.471 -0.768 . . . . 0.0 108.944 178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.83 74.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.589 -0.694 . . . . 0.0 109.245 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -68.03 -36.34 79.77 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.52 -0.738 . . . . 0.0 109.211 179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.4 mt -67.26 -39.49 83.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.359 -0.838 . . . . 0.0 108.851 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.409 ' O ' ' N ' ' B' ' 35' ' ' GLY . 53.1 tt0 -60.27 -47.92 83.95 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 119.866 -0.734 . . . . 0.0 109.233 178.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.39 -26.89 63.72 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.131 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.1 mmtm -83.92 -43.42 15.29 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.31 -0.869 . . . . 0.0 110.729 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -107.94 -53.3 2.65 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.373 -0.83 . . . . 0.0 110.595 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 124.46 19.65 2.54 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.535 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.3 mt -91.35 145.26 31.1 Favored Pre-proline 0 N--CA 1.492 1.626 0 O-C-N 121.17 -1.194 . . . . 0.0 109.715 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.535 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.2 Cg_endo -67.63 132.13 26.2 Favored 'Trans proline' 0 C--N 1.309 -1.509 0 O-C-N 123.629 1.331 . . . . 0.0 110.245 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -60.63 -25.87 81.75 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.751 1.395 . . . . 0.0 110.919 -179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.01 -24.29 64.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.373 -0.829 . . . . 0.0 110.07 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . . . . . . . . . 13.7 mt-30 -101.32 0.99 38.15 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.37 -0.831 . . . . 0.0 110.605 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -94.12 140.41 29.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.2 -0.937 . . . . 0.0 110.377 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtt-85 -130.05 130.86 45.46 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.841 ' HB3' HD12 ' B' ' 50' ' ' LEU . 14.4 mt -104.89 128.06 52.97 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.137 -0.977 . . . . 0.0 110.39 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.46 HG13 ' HB3' ' A' ' 96' ' ' ALA . 8.3 mm -120.76 130.04 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.679 -0.638 . . . . 0.0 109.771 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.644 ' HB3' HD21 ' B' ' 50' ' ' LEU . 74.2 t80 -140.88 149.2 41.63 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.44 27.74 0.41 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.45 -0.781 . . . . 0.0 111.117 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.662 ' HA3' HD22 ' A' ' 101' ' ' LEU . . . 78.55 -0.5 75.89 Favored Glycine 0 N--CA 1.494 2.533 0 N-CA-C 110.613 -0.995 . . . . 0.0 110.613 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -111.08 142.83 42.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.03 -1.276 . . . . 0.0 110.229 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -78.46 137.8 38.14 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.296 -0.878 . . . . 0.0 109.673 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.841 HD12 ' HB3' ' B' ' 43' ' ' LEU . 21.6 mt -84.06 137.36 33.61 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.253 -0.904 . . . . 0.0 110.286 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -93.77 128.88 40.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.436 -0.79 . . . . 0.0 110.711 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.5 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 2.8 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.471 -0.768 . . . . 0.0 111.189 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.74 -11.23 82.0 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -99.27 157.43 16.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.153 -1.204 . . . . 0.0 110.431 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.502 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 72.9 p -102.31 164.29 11.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.368 -0.832 . . . . 0.0 110.103 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.805 ' HA ' HD12 ' B' ' 61' ' ' ILE . 5.9 mp -52.68 -43.57 65.66 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.258 -0.901 . . . . 0.0 110.504 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -56.84 -38.88 73.27 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.28 -0.887 . . . . 0.0 110.738 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -59.7 -28.4 67.27 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.297 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.524 ' CG ' HD22 ' B' ' 50' ' ' LEU . 43.2 m-85 -101.14 28.56 5.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.397 -0.814 . . . . 0.0 109.79 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 12.6 t30 50.82 29.56 4.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.611 -0.681 . . . . 0.0 111.067 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.7 mt -81.53 108.23 14.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.173 -0.955 . . . . 0.0 109.632 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -105.7 171.93 7.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.361 -0.837 . . . . 0.0 110.529 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.51 148.49 0.96 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.625 -0.672 . . . . 0.0 111.076 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 41.6 mt-10 62.76 19.61 11.55 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.723 -0.611 . . . . 0.0 110.615 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.31 147.76 47.77 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.143 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 29.8 m -107.76 108.67 19.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.281 -0.887 . . . . 0.0 109.954 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.608 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.5 mt -102.42 157.76 16.69 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.392 -0.817 . . . . 0.0 110.343 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.532 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 49.0 m80 -108.45 138.3 44.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.451 -0.781 . . . . 0.0 109.636 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.567 HD23 HG22 ' B' ' 7' ' ' THR . 64.6 tp -107.37 134.89 49.76 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.077 -1.015 . . . . 0.0 110.715 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.1 t -124.85 152.24 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.542 -0.724 . . . . 0.0 109.736 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.45 134.9 36.48 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.419 -0.801 . . . . 0.0 110.212 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.18 129.34 56.26 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.312 -0.868 . . . . 0.0 110.088 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mt -90.96 135.1 33.97 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.315 -0.866 . . . . 0.0 110.323 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.58 76.14 6.21 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.356 -0.84 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 113.13 142.45 8.35 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.392 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -179.956 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 28.9 t-80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.174 0.511 . . . . 0.0 110.257 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -163.66 -177.91 5.47 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.424 -0.798 . . . . 0.0 110.177 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.9 mt -112.78 25.23 11.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.447 -0.783 . . . . 0.0 109.656 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.22 -125.44 1.03 Allowed Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.9 mt -127.54 -48.08 1.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.375 -1.074 . . . . 0.0 110.175 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.61 24.34 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.491 -1.444 . . . . 0.0 109.491 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.71 -33.55 5.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.422 -1.046 . . . . 0.0 110.198 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 t -86.08 3.04 44.24 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.335 -0.853 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.27 -27.02 24.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.182 -0.949 . . . . 0.0 110.22 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -137.86 106.93 6.01 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.355 -0.841 . . . . 0.0 110.226 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -131.38 50.97 2.18 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.44 -0.788 . . . . 0.0 110.275 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -128.8 -63.57 0.96 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.344 -0.847 . . . . 0.0 110.221 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -132.93 25.18 3.74 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.8 t -118.19 -23.28 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.41 -1.053 . . . . 0.0 110.405 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.563 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.1 OUTLIER -59.36 -179.31 0.15 Allowed Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.309 -0.87 . . . . 0.0 110.132 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.675 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.8 Cg_endo -60.71 78.39 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.271 0 O-C-N 123.542 1.285 . . . . 0.0 111.034 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.465 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 68.86 44.78 1.05 Allowed 'General case' 0 N--CA 1.497 1.908 0 CA-C-O 121.819 0.819 . . . . 0.0 108.964 -179.674 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 41.74 27.83 0.07 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.332 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -169.75 110.22 0.47 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.118 -0.988 . . . . 0.0 110.53 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -73.12 -13.47 25.96 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.047 1.551 . . . . 0.0 109.846 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.63 -31.47 61.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.425 -0.797 . . . . 0.0 109.423 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.456 ' N ' HD12 ' A' ' 22' ' ' LEU . 10.6 mp -85.7 -27.99 24.96 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.582 -0.699 . . . . 0.0 109.268 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.675 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -72.17 -39.22 68.84 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.466 -0.771 . . . . 0.0 109.728 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.736 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -81.57 -34.02 31.31 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.745 179.79 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.67 -42.21 98.6 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.438 -0.788 . . . . 0.0 109.926 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.68 -21.98 44.02 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.405 -0.809 . . . . 0.0 110.195 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.5 -31.55 37.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.313 -0.867 . . . . 0.0 109.173 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.736 HG23 ' O ' ' A' ' 24' ' ' LEU . 93.8 t -77.14 -27.84 16.34 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.572 -0.705 . . . . 0.0 109.624 179.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -43.54 57.65 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.385 -0.822 . . . . 0.0 109.917 179.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 3.3 mtt -63.61 -45.59 89.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.501 -0.749 . . . . 0.0 109.955 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -63.82 -34.4 77.84 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.306 -0.871 . . . . 0.0 110.08 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.32 -42.65 99.0 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.397 -0.814 . . . . 0.0 110.105 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.56 -37.85 87.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.413 -0.804 . . . . 0.0 110.018 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -33.09 69.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.376 -0.827 . . . . 0.0 110.034 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -61.51 -47.67 84.56 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.312 -0.868 . . . . 0.0 110.041 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.7 mmt180 -66.49 -35.17 79.59 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.34 -0.85 . . . . 0.0 109.944 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.526 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.7 OUTLIER -77.96 -24.5 48.12 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.459 -0.775 . . . . 0.0 110.054 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -83.94 -59.67 2.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.436 -0.79 . . . . 0.0 109.567 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -52.83 -31.1 37.23 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.2 -38.42 22.3 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.671 -0.643 . . . . 0.0 109.629 179.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.526 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.5 -55.81 8.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.308 -0.87 . . . . 0.0 109.874 179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -55.82 -40.03 72.21 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.567 -0.708 . . . . 0.0 110.248 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -59.23 -34.48 72.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.261 -0.899 . . . . 0.0 109.792 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.89 -29.78 62.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.494 -0.754 . . . . 0.0 109.787 179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.71 -27.94 60.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.446 -0.784 . . . . 0.0 110.042 179.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -82.97 -41.12 19.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.386 -0.821 . . . . 0.0 110.173 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.81 -34.06 77.29 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.858 . . . . 0.0 110.117 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.87 -39.96 41.61 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.349 -0.844 . . . . 0.0 110.168 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.1 -38.34 66.41 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.4 -0.812 . . . . 0.0 110.1 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.75 -30.52 70.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.318 -0.863 . . . . 0.0 110.137 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.13 84.15 5.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.384 -0.823 . . . . 0.0 110.14 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 54.19 27.69 8.13 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.361 -0.837 . . . . 0.0 110.344 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -114.56 -15.55 8.08 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.949 -1.26 . . . . 0.0 109.949 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.781 HD13 ' O ' ' A' ' 54' ' ' ILE . 0.1 OUTLIER -58.2 -34.8 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.182 -1.187 . . . . 0.0 110.157 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.93 97.75 1.48 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.331 -0.856 . . . . 0.0 110.138 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.5 ' O ' HG23 ' A' ' 57' ' ' THR . 27.0 p -120.9 124.85 45.96 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.348 -0.845 . . . . 0.0 110.24 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.5 HG23 ' O ' ' A' ' 56' ' ' THR . 11.6 p -153.41 112.87 3.82 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.353 -0.842 . . . . 0.0 110.287 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -159.84 -56.97 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.402 ' O ' HG23 ' A' ' 59' ' ' THR . 6.7 t -154.52 56.36 0.69 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.365 -1.079 . . . . 0.0 110.204 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -98.94 60.67 1.24 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.389 -0.819 . . . . 0.0 110.145 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -94.21 -40.32 10.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.359 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.4 m -126.59 95.31 4.31 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.322 -0.861 . . . . 0.0 110.345 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -59.36 -30.27 68.28 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.332 -0.855 . . . . 0.0 110.084 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -76.43 -29.69 57.11 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.212 -0.93 . . . . 0.0 109.118 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.8 96.92 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.543 -0.863 . . . . 0.0 108.841 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -30.75 70.77 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 178.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.4 tt -73.24 -44.94 58.63 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.559 -0.713 . . . . 0.0 109.862 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.49 -53.66 7.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.24 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -52.3 -38.86 59.6 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.108 -0.995 . . . . 0.0 110.565 -179.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.3 m -69.43 -39.67 77.7 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.27 -0.894 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 68' ' ' LYS . 4.8 tp -82.36 -19.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 41.8 t -70.76 -41.23 72.04 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.304 -0.873 . . . . 0.0 109.789 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -80.27 -30.16 38.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.382 -0.824 . . . . 0.0 109.93 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -79.57 -42.96 23.89 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.377 -0.827 . . . . 0.0 110.02 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -65.05 -38.99 92.63 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.318 -0.864 . . . . 0.0 110.028 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -83.99 -31.46 25.49 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.367 -0.833 . . . . 0.0 110.361 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -73.36 64.15 1.73 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 50.68 69.96 0.57 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.362 -1.081 . . . . 0.0 110.774 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.0 t -49.73 -29.83 8.3 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.913 0.863 . . . . 0.0 109.367 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.456 ' O ' HD23 ' A' ' 81' ' ' LEU . . . -165.49 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.485 1.944 0 N-CA-C 107.988 -2.045 . . . . 0.0 107.988 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 80' ' ' GLY . 61.3 mt -155.91 148.6 17.97 Favored Pre-proline 0 N--CA 1.486 1.346 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.83 36.21 0.55 Allowed 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 123.47 1.247 . . . . 0.0 110.876 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 50.86 86.84 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.175 -0.953 . . . . 0.0 110.654 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.544 HD11 HD22 ' B' ' 8' ' ' LEU . 0.2 OUTLIER -78.46 -31.56 48.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.281 -0.887 . . . . 0.0 110.035 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -62.88 -22.27 66.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.374 -0.829 . . . . 0.0 110.245 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.1 t -86.56 -26.52 24.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.405 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 37.8 mtt -69.42 118.93 12.92 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.315 -0.865 . . . . 0.0 109.98 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 72.9 p -78.36 -160.74 0.22 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.496 -0.753 . . . . 0.0 110.68 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.547 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 1.1 mt-10 -69.07 -33.3 73.32 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.535 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.2 mp0 -85.92 -36.81 19.66 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.893 -0.723 . . . . 0.0 109.283 179.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.67 -45.46 86.64 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 178.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.61 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 -68.36 -34.53 76.24 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.547 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.4 OUTLIER -64.57 -39.31 85.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.487 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.06 -33.49 67.29 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.785 ' CD2' HD23 ' B' ' 8' ' ' LEU . 15.0 t80 -68.12 -39.27 82.81 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.807 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -70.02 -43.02 72.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.684 -0.635 . . . . 0.0 109.673 179.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.463 ' N ' HG21 ' B' ' 44' ' ' ILE . 29.5 mtt -78.29 -13.12 59.99 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.395 -0.816 . . . . 0.0 110.08 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.74 -49.07 11.63 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . 0.403 ' HB2' ' NE2' ' B' ' 68' ' ' HIS . 6.1 mtm -78.59 -16.5 57.33 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.385 -0.822 . . . . 0.0 110.649 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.7 m -87.32 -29.14 21.8 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.216 -0.927 . . . . 0.0 110.186 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.414 ' HA ' HD22 ' A' ' 101' ' ' LEU . 0.1 OUTLIER -60.45 -24.13 64.99 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.34 -0.85 . . . . 0.0 110.05 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.61 36.47 2.62 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.443 -0.786 . . . . 0.0 110.066 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.78 -82.06 0.92 Allowed Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -140.11 94.99 2.82 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.452 -1.028 . . . . 0.0 110.237 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -153.7 82.08 1.16 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.306 -0.871 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -137.21 -64.17 0.57 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.43 -0.794 . . . . 0.0 110.285 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 147.29 -44.92 0.78 Allowed Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -123.43 93.18 3.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.393 -1.063 . . . . 0.0 110.32 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -165.53 -67.86 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.367 -0.833 . . . . 0.0 110.189 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -93.05 -34.12 13.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.407 -0.808 . . . . 0.0 110.259 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -96.21 176.06 6.22 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 110.187 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.215 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.475 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 42.1 ttp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.196 0.522 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.401 ' NE2' ' CG2' ' B' ' 14' ' ' THR . 0.2 OUTLIER -109.35 138.87 45.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.447 -0.783 . . . . 0.0 109.722 179.473 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.518 HD13 HG21 ' B' ' 17' ' ' VAL . 43.6 pt -137.41 157.8 34.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.197 -0.939 . . . . 0.0 110.384 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -111.99 146.88 37.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.618 -0.676 . . . . 0.0 110.725 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 61.6 t -127.78 118.42 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 O-C-N 121.431 -0.793 . . . . 0.0 109.533 179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.0 OUTLIER -100.31 128.15 46.45 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.52 -0.737 . . . . 0.0 110.243 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.529 HG22 HD23 ' B' ' 69' ' ' LEU . 76.1 p -95.72 176.07 6.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.36 -0.838 . . . . 0.0 110.387 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.785 HD23 ' CD2' ' A' ' 95' ' ' TYR . 2.8 mt -61.51 -14.78 32.19 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.432 -0.793 . . . . 0.0 110.844 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 66.8 p -95.84 19.88 10.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.168 -0.957 . . . . 0.0 110.587 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 65.84 14.1 60.31 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 179.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.82 128.89 34.83 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.073 -1.251 . . . . 0.0 110.002 179.748 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 9.6 m -113.03 125.13 54.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.166 -0.959 . . . . 0.0 110.211 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.402 HD13 HG21 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -109.84 141.86 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.283 -0.886 . . . . 0.0 110.369 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.529 ' O ' HD12 ' B' ' 15' ' ' LEU . 7.5 m -102.15 121.73 42.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.329 -0.857 . . . . 0.0 109.403 179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.562 HD23 ' HB3' ' B' ' 29' ' ' LYS . 3.6 mp -123.33 156.17 35.86 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.287 -0.883 . . . . 0.0 110.968 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -106.38 114.19 28.15 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.522 -0.736 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.518 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.25 175.15 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.268 -0.895 . . . . 0.0 110.863 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.431 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.7 mt-10 -113.34 165.5 13.17 Favored Pre-proline 0 N--CA 1.488 1.466 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -73.07 -27.72 13.65 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.456 1.24 . . . . 0.0 110.418 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.32 -2.63 57.38 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.166 -0.959 . . . . 0.0 110.467 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -71.17 145.72 49.55 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.132 -0.98 . . . . 0.0 110.3 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 59.7 p -83.03 155.63 23.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.527 -0.733 . . . . 0.0 110.273 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 45.7 mm -59.72 -34.68 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.327 -0.858 . . . . 0.0 109.688 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.91 -36.96 82.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.431 -0.793 . . . . 0.0 109.386 179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -70.21 -31.78 69.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.413 -0.804 . . . . 0.0 109.226 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 69.0 t -70.22 -40.44 78.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.482 -0.761 . . . . 0.0 109.071 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 66.1 mttt -63.13 -42.21 99.45 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.48 -0.763 . . . . 0.0 109.156 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.05 -34.41 74.83 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 109.042 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.562 ' HB3' HD23 ' B' ' 15' ' ' LEU . 1.7 mttp -68.16 -34.15 75.78 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 17.0 mt -67.78 -42.4 86.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.418 -0.801 . . . . 0.0 109.133 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.32 -51.76 68.13 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.516 -0.74 . . . . 0.0 109.812 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -57.99 -25.58 61.25 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.367 -0.833 . . . . 0.0 110.474 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -84.09 -41.85 16.71 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.257 -0.902 . . . . 0.0 110.72 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -108.17 -53.57 2.61 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.399 -0.813 . . . . 0.0 110.576 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 128.41 14.36 2.42 Favored Glycine 0 N--CA 1.492 2.423 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.5 mt -91.29 143.4 28.24 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.041 -1.27 . . . . 0.0 109.972 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.546 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 39.3 Cg_endo -68.18 136.83 38.7 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 O-C-N 123.605 1.318 . . . . 0.0 110.705 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.94 -26.07 82.52 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.789 1.415 . . . . 0.0 111.043 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -68.63 -23.92 64.49 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 109.788 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.546 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 13.9 mp0 -101.14 2.54 40.31 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.504 -0.747 . . . . 0.0 110.536 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -94.26 138.0 32.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.179 -0.951 . . . . 0.0 110.602 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.428 ' HD2' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.02 125.31 35.0 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.449 -0.782 . . . . 0.0 109.561 179.555 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 18.2 mt -104.59 122.88 46.53 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.21 -0.931 . . . . 0.0 110.834 -179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.807 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.03 132.91 69.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.683 -0.636 . . . . 0.0 109.797 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.629 ' HB2' HD23 ' B' ' 67' ' ' LEU . 66.7 t80 -140.78 143.73 35.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.422 -0.799 . . . . 0.0 109.875 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.43 28.58 0.49 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.368 -0.833 . . . . 0.0 111.164 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.89 2.38 88.45 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 110.469 -1.053 . . . . 0.0 110.469 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -110.91 132.96 53.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.078 -1.248 . . . . 0.0 110.309 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.15 136.68 37.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.279 -0.888 . . . . 0.0 109.28 179.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.68 HD12 ' HB3' ' B' ' 43' ' ' LEU . 42.8 mt -83.56 135.95 34.44 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.216 -0.927 . . . . 0.0 110.589 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -93.76 128.7 40.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.388 -0.82 . . . . 0.0 110.74 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.475 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.5 p30 -48.71 -26.78 2.49 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 121.402 -0.811 . . . . 0.0 111.333 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.98 -11.69 80.9 Favored Glycine 0 N--CA 1.495 2.574 0 C-N-CA 120.129 -1.034 . . . . 0.0 110.533 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 13.1 mmt85 -99.54 161.12 13.8 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.101 -1.234 . . . . 0.0 110.491 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 68.6 p -102.31 163.02 12.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.242 -0.911 . . . . 0.0 110.374 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.431 HD12 ' O ' ' B' ' 18' ' ' GLU . 72.0 mt -53.76 -43.92 69.57 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.368 -0.832 . . . . 0.0 110.849 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 33.9 t -56.64 -34.19 67.05 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.43 -0.793 . . . . 0.0 111.057 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -59.64 -26.97 65.95 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.305 -0.872 . . . . 0.0 110.395 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.579 ' CG ' HD22 ' B' ' 50' ' ' LEU . 91.5 m-85 -100.74 23.86 9.92 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.137 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 11.4 m120 50.64 30.93 5.24 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.452 -0.78 . . . . 0.0 110.671 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 91.0 mt -81.36 113.17 20.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.312 -0.867 . . . . 0.0 109.909 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.65 169.4 8.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.394 -0.817 . . . . 0.0 110.19 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.2 OUTLIER -46.59 155.01 0.26 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.6 -0.687 . . . . 0.0 111.072 -179.837 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 36.1 mt-10 63.11 15.13 8.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.731 -0.606 . . . . 0.0 110.778 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 144.43 49.49 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.243 -0.91 . . . . 0.0 110.179 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 93.2 m -107.67 112.4 25.09 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.247 -0.908 . . . . 0.0 109.826 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.629 HD23 ' HB2' ' B' ' 45' ' ' PHE . 5.2 mt -102.61 159.86 15.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.277 -0.889 . . . . 0.0 110.159 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.403 ' NE2' ' HB2' ' A' ' 99' ' ' MET . 47.2 m80 -108.71 135.05 50.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.315 -0.866 . . . . 0.0 109.484 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.529 HD23 HG22 ' B' ' 7' ' ' THR . 21.0 tp -107.0 132.22 53.18 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.247 -0.908 . . . . 0.0 110.878 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.61 HG13 ' HB3' ' A' ' 92' ' ' GLN . 67.8 t -124.78 163.08 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.529 -0.732 . . . . 0.0 109.564 179.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.0 mt -93.69 130.78 39.51 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.348 -0.845 . . . . 0.0 110.527 -179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.436 ' HA ' ' CG ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -103.76 89.11 3.22 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.441 -0.787 . . . . 0.0 110.035 179.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.25 172.41 0.62 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.268 -0.895 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.8 33.27 2.6 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.449 -0.782 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.45 -167.19 38.1 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.545 -1.422 . . . . 0.0 109.545 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.229 0 CA-C-O 118.013 -1.437 . . . . 0.0 109.575 179.952 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.057 0.456 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.6 mtp 53.23 -179.86 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.265 -0.897 . . . . 0.0 110.5 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.51 24.77 12.15 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.418 -0.801 . . . . 0.0 109.627 179.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.63 -34.73 8.99 Favored Glycine 0 N--CA 1.488 2.15 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 5' ' ' LEU . 2.9 mm? -107.86 75.3 0.99 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.372 -1.075 . . . . 0.0 110.287 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -129.14 -97.82 0.86 Allowed Glycine 0 N--CA 1.491 2.364 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.96 70.33 1.08 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.373 -1.075 . . . . 0.0 110.255 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.8 p -156.81 -43.93 0.07 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.352 -0.842 . . . . 0.0 110.242 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -69.55 -30.04 67.76 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.442 -0.786 . . . . 0.0 110.113 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -131.33 103.17 6.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.429 -0.794 . . . . 0.0 110.071 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -108.6 39.36 2.02 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.384 -0.823 . . . . 0.0 110.276 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -136.06 15.16 3.29 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.348 -0.845 . . . . 0.0 110.554 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.67 49.97 55.67 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 33.9 m -51.54 -25.81 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.432 -1.04 . . . . 0.0 110.425 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -135.43 145.86 55.41 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.998 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.65 -15.79 30.31 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 O-C-N 123.645 1.339 . . . . 0.0 110.771 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 88.5 p -72.55 -6.29 42.93 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.299 -0.876 . . . . 0.0 110.703 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.98 21.42 13.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.114 -0.991 . . . . 0.0 110.337 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -169.55 118.51 0.56 Allowed Pre-proline 0 N--CA 1.489 1.511 0 O-C-N 121.289 -0.882 . . . . 0.0 109.853 179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 19' ' ' ASP . 50.2 Cg_endo -70.34 -14.4 34.21 Favored 'Trans proline' 0 C--N 1.306 -1.709 0 O-C-N 124.0 1.526 . . . . 0.0 110.262 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -35.2 35.72 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.354 -0.842 . . . . 0.0 109.479 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.35 -27.72 22.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.452 -0.78 . . . . 0.0 109.419 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.69 -39.08 70.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.462 -0.774 . . . . 0.0 109.539 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.73 ' O ' HG23 ' A' ' 28' ' ' VAL . 16.6 tp -80.04 -30.66 39.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.508 -0.745 . . . . 0.0 109.673 179.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.16 98.19 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 109.848 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 60.3 tp -80.63 -21.61 41.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.427 -0.796 . . . . 0.0 110.052 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.51 -28.77 37.36 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.328 -0.857 . . . . 0.0 109.287 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.73 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -81.64 -32.45 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 O-C-N 121.562 -0.711 . . . . 0.0 109.546 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.4 m -69.35 -43.59 73.33 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.546 -0.721 . . . . 0.0 109.814 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 35.9 mtp -67.31 -37.48 83.41 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.491 -0.756 . . . . 0.0 109.908 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -63.38 -41.4 98.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.386 -0.821 . . . . 0.0 110.032 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -61.91 -44.53 96.6 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.413 -0.805 . . . . 0.0 109.991 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -36.42 83.54 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.449 -0.782 . . . . 0.0 109.864 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.9 tpp180 -67.04 -37.88 84.88 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.353 -0.842 . . . . 0.0 109.897 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.98 -35.11 77.51 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.451 -0.781 . . . . 0.0 109.955 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.9 mtm180 -71.69 -31.79 67.15 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.381 -0.825 . . . . 0.0 110.074 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.568 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 23.8 mm100 -77.3 -31.51 54.75 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.367 -0.833 . . . . 0.0 109.996 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -83.99 -55.13 4.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.485 -0.76 . . . . 0.0 109.599 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.4 mm-40 -54.2 -29.06 44.77 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.311 -0.868 . . . . 0.0 109.315 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -89.61 -34.76 16.2 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.705 -0.622 . . . . 0.0 109.719 179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -70.33 -39.22 74.87 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.206 -0.934 . . . . 0.0 110.122 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 53.3 mtt-85 -76.89 -37.23 55.87 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.43 -0.794 . . . . 0.0 110.252 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -58.84 -39.38 81.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.209 -0.932 . . . . 0.0 109.893 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.64 -29.8 62.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.493 -0.754 . . . . 0.0 109.687 179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.62 -24.94 62.83 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.443 -0.786 . . . . 0.0 110.071 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.15 -37.4 18.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.837 . . . . 0.0 110.309 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.64 -27.55 65.15 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.291 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 52' ' ' ALA . 3.1 m -93.36 -28.99 15.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.381 -0.824 . . . . 0.0 110.271 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.69 -25.1 41.32 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.314 -0.866 . . . . 0.0 110.367 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -92.88 -18.42 22.84 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.31 -0.868 . . . . 0.0 110.447 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -112.01 -42.39 3.77 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.189 -0.944 . . . . 0.0 110.305 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.731 ' HB3' ' O ' ' A' ' 48' ' ' SER . . . -88.67 -31.62 18.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.345 -0.847 . . . . 0.0 110.31 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -118.27 51.27 0.76 Allowed Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 54' ' ' ILE . 14.6 tt -68.3 75.46 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.332 -1.099 . . . . 0.0 110.253 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -154.63 154.12 32.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.297 -0.877 . . . . 0.0 110.079 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 13.3 p -107.55 103.19 12.45 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.408 -0.808 . . . . 0.0 110.288 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 27.6 p -104.06 97.69 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.336 -0.853 . . . . 0.0 110.119 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -153.8 76.69 0.22 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.6 p -85.34 73.9 10.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.415 -1.05 . . . . 0.0 110.135 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.417 ' O ' ' N ' ' A' ' 62' ' ' SER . 1.2 mt-10 -102.27 43.62 1.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.432 -0.793 . . . . 0.0 110.5 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.617 ' O ' ' N ' ' A' ' 63' ' ' ASP . 20.7 m-20 -55.74 97.17 0.02 OUTLIER 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.48 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 1.0 OUTLIER -50.98 78.45 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 121.637 0.732 . . . . 0.0 110.85 -177.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.617 ' N ' ' O ' ' A' ' 61' ' ' ASP . 5.0 t0 -77.75 -56.95 4.09 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.673 -0.642 . . . . 0.0 110.1 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -75.8 -29.31 58.68 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.22 -0.925 . . . . 0.0 109.313 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.48 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -62.94 -34.92 78.5 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.459 -0.896 . . . . 0.0 108.728 179.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.447 ' O ' HG23 ' A' ' 70' ' ' THR . 16.1 tp -71.31 -31.72 67.75 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 tt -75.51 -40.4 57.13 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.616 -0.677 . . . . 0.0 109.639 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.407 ' O ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -78.05 -50.57 11.81 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.507 -0.745 . . . . 0.0 110.108 179.941 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 31.4 tpp -52.6 -37.43 58.16 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.206 -0.934 . . . . 0.0 110.412 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 66' ' ' LEU . 16.2 p -70.46 -42.52 71.34 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.351 -0.843 . . . . 0.0 110.434 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.41 ' HA ' HD12 ' A' ' 71' ' ' ILE . 5.4 tp -79.76 -18.88 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.189 -0.944 . . . . 0.0 109.893 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.0 t -69.97 -44.8 68.73 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.36 -0.838 . . . . 0.0 109.559 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -74.46 -28.85 61.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.386 -0.821 . . . . 0.0 109.701 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.51 -34.71 31.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.356 -0.84 . . . . 0.0 110.007 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -66.0 -53.21 41.63 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.372 -0.83 . . . . 0.0 110.18 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -61.54 -30.88 70.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.07 -36.76 45.21 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.98 123.06 27.99 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -1.106 . . . . 0.0 110.124 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -144.79 42.36 1.33 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.452 -0.78 . . . . 0.0 110.272 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -102.4 27.68 19.25 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.517 -1.433 . . . . 0.0 109.517 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.599 HD12 ' N ' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -174.81 152.29 1.55 Allowed Pre-proline 0 N--CA 1.488 1.428 0 O-C-N 121.319 -1.106 . . . . 0.0 108.901 179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.87 0.6 Allowed 'Trans proline' 0 C--N 1.304 -1.803 0 O-C-N 123.595 1.313 . . . . 0.0 110.885 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.599 ' N ' HD12 ' A' ' 81' ' ' LEU . 1.3 t0 50.71 63.51 2.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.143 -0.973 . . . . 0.0 110.609 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.7 tp -61.93 -34.81 76.77 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.348 -0.845 . . . . 0.0 110.256 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 25.1 p -60.44 -25.79 66.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.315 -0.866 . . . . 0.0 110.398 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 p -83.76 -23.27 31.61 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.391 -0.818 . . . . 0.0 110.058 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.413 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 15.9 mtt -82.02 118.45 23.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.359 -0.838 . . . . 0.0 109.866 179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -76.42 -167.54 0.81 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.382 -0.823 . . . . 0.0 110.621 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.552 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 13.3 pt-20 -66.57 -29.73 69.86 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.548 -0.72 . . . . 0.0 109.157 179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.501 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 47.4 mt-10 -85.32 -41.83 15.15 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -46.07 89.93 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.57 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.5 mt-30 -66.24 -34.21 77.49 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.552 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -61.93 -40.02 85.68 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.226 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.14 66.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -63.98 -52.6 58.88 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 121.341 0.591 . . . . 0.0 110.018 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -73.52 -27.96 61.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.454 -0.779 . . . . 0.0 110.384 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.409 ' HG3' ' HA2' ' B' ' 47' ' ' GLY . 3.0 ttt -81.22 -24.22 37.55 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.757 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 22.7 tt0 -81.82 -23.91 36.21 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.376 -0.828 . . . . 0.0 110.36 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 20.0 mmm -94.0 -18.44 21.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.244 -0.91 . . . . 0.0 110.484 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 89.6 p -92.99 -23.37 18.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.247 -0.908 . . . . 0.0 110.653 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 5.1 tp -71.13 -9.66 58.44 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.229 -0.919 . . . . 0.0 110.625 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -65.8 -45.86 80.82 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.148 -0.97 . . . . 0.0 110.172 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 85.08 113.63 0.72 Allowed Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.497 -1.441 . . . . 0.0 109.497 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -91.39 82.05 5.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.372 -1.075 . . . . 0.0 110.267 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -92.58 -27.89 17.07 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.396 -0.815 . . . . 0.0 110.112 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -94.35 17.84 12.17 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.363 -0.835 . . . . 0.0 110.427 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -98.52 83.17 0.63 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -104.29 81.65 1.85 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.379 -1.071 . . . . 0.0 110.28 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -91.13 -34.86 14.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 110.166 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -155.86 -52.07 0.08 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.336 -0.853 . . . . 0.0 110.252 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -147.59 136.63 22.21 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.375 -0.828 . . . . 0.0 110.254 179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.158 179.902 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ptt? . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.313 0.578 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' B' ' 15' ' ' LEU . 6.4 mt-30 -101.83 146.69 27.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.46 -0.775 . . . . 0.0 110.119 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.401 HD13 HG21 ' B' ' 17' ' ' VAL . 17.5 pt -137.46 158.05 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.288 -0.882 . . . . 0.0 110.159 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.96 143.01 43.64 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.662 -0.649 . . . . 0.0 110.899 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.6 t -128.28 125.93 65.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.427 -0.795 . . . . 0.0 109.547 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 1.6 mtpt -100.0 129.06 46.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.293 -0.879 . . . . 0.0 110.251 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.598 HG22 HD23 ' B' ' 69' ' ' LEU . 66.9 p -95.54 178.13 5.58 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.295 -0.878 . . . . 0.0 110.741 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.487 HD22 ' N ' ' B' ' 8' ' ' LEU . 4.6 mm? -61.19 -15.89 38.95 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.521 -0.737 . . . . 0.0 111.048 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.6 p -95.72 17.52 14.85 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 67.45 11.06 58.92 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.416 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 43.0 tttt -84.89 136.89 33.45 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.068 -1.254 . . . . 0.0 109.836 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 6.6 m -113.34 128.39 56.45 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.293 -0.879 . . . . 0.0 110.169 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 21.9 mt -109.03 137.06 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.353 -0.842 . . . . 0.0 110.339 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 2.1 m -102.02 120.26 40.13 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.439 -0.788 . . . . 0.0 109.098 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.561 HD11 HG12 ' B' ' 30' ' ' ILE . 65.1 mt -123.26 163.85 19.89 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.126 -0.984 . . . . 0.0 110.97 -179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -106.31 112.73 25.87 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.532 -0.73 . . . . 0.0 109.287 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.401 HG21 HD13 ' B' ' 3' ' ' ILE . 34.0 m -140.47 169.4 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.288 -0.883 . . . . 0.0 110.993 -179.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.459 ' O ' HD12 ' B' ' 56' ' ' LEU . 10.6 mt-10 -112.75 165.7 12.56 Favored Pre-proline 0 N--CA 1.489 1.489 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -71.96 -26.51 18.51 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 123.543 1.286 . . . . 0.0 110.51 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -84.43 -3.94 58.63 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.086 -1.009 . . . . 0.0 110.547 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -71.33 144.23 49.99 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.425 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 49.2 p -83.07 158.39 22.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.544 -0.722 . . . . 0.0 110.383 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.847 HG23 HD12 ' B' ' 43' ' ' LEU . 41.3 mm -59.59 -34.74 55.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.316 -0.865 . . . . 0.0 109.485 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.14 -36.28 79.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.309 -0.869 . . . . 0.0 109.179 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -70.33 -31.89 69.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.526 -0.734 . . . . 0.0 109.213 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.422 HG21 HD21 ' B' ' 56' ' ' LEU . 60.4 t -70.24 -39.96 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.419 -0.801 . . . . 0.0 109.11 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 4.9 mttm -62.98 -43.72 98.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.51 -0.744 . . . . 0.0 109.094 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.31 -32.88 72.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.486 -0.759 . . . . 0.0 109.411 179.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -38.89 81.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.526 -0.734 . . . . 0.0 109.515 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.561 HG12 HD11 ' B' ' 15' ' ' LEU . 9.5 mt -67.46 -42.18 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.47 -0.769 . . . . 0.0 109.424 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -48.39 81.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.354 -0.841 . . . . 0.0 109.622 179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -58.05 -27.77 63.9 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.439 -0.788 . . . . 0.0 110.287 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.438 ' HG3' HD22 ' B' ' 15' ' ' LEU . 3.4 mmtm -83.49 -42.29 17.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.352 -0.842 . . . . 0.0 110.015 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -108.3 -119.12 0.26 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.442 -0.786 . . . . 0.0 109.712 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.4 21.32 0.24 Allowed Glycine 0 N--CA 1.491 2.354 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.466 HG23 ' HD2' ' B' ' 37' ' ' PRO . 14.3 mt -91.99 142.99 27.01 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.181 -1.188 . . . . 0.0 110.105 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.466 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -69.4 136.25 33.44 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 O-C-N 123.685 1.36 . . . . 0.0 110.29 179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -60.98 -28.12 85.82 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 O-C-N 123.623 1.328 . . . . 0.0 111.049 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.97 -23.05 64.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.305 -0.872 . . . . 0.0 110.299 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.426 ' CG ' ' HG2' ' B' ' 37' ' ' PRO . 33.4 mt-30 -101.29 5.98 42.64 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.255 -0.903 . . . . 0.0 110.701 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -94.36 139.45 31.08 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.16 -0.963 . . . . 0.0 110.368 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.488 ' O ' HD12 ' B' ' 69' ' ' LEU . 0.1 OUTLIER -129.89 131.74 46.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 109.744 179.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 23' ' ' ILE . 18.4 mt -104.88 124.89 50.25 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.637 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.435 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 15.5 mm -120.86 132.43 70.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.658 -0.651 . . . . 0.0 109.57 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.482 ' HB2' HD23 ' B' ' 67' ' ' LEU . 54.7 t80 -140.93 139.03 34.24 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.355 -0.841 . . . . 0.0 109.963 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.6 28.49 0.53 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.497 -0.752 . . . . 0.0 111.171 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.409 ' HA2' ' HG3' ' A' ' 97' ' ' MET . . . 82.53 2.74 90.66 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 110.562 -1.015 . . . . 0.0 110.562 179.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.08 129.35 55.95 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.106 -1.232 . . . . 0.0 110.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -78.29 134.34 37.52 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.306 -0.871 . . . . 0.0 109.424 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.848 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.8 mt -84.18 140.38 31.77 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.225 -0.922 . . . . 0.0 110.513 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -93.8 133.32 37.31 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.368 -0.832 . . . . 0.0 110.411 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.3 -26.68 2.11 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.518 -0.739 . . . . 0.0 111.286 179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.05 -9.25 84.52 Favored Glycine 0 N--CA 1.494 2.551 0 C-N-CA 120.187 -1.006 . . . . 0.0 110.696 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.454 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.36 158.34 15.79 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.02 -1.283 . . . . 0.0 110.493 -179.739 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.546 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 40.6 p -102.28 163.07 12.44 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.368 -0.832 . . . . 0.0 110.166 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.459 HD12 ' O ' ' B' ' 18' ' ' GLU . 89.4 mt -53.56 -44.36 69.23 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.388 -0.82 . . . . 0.0 110.795 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.4 t -56.64 -34.02 66.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.377 -0.827 . . . . 0.0 110.817 -179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.6 m-20 -59.67 -28.02 66.91 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.262 -0.899 . . . . 0.0 110.182 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.848 ' CG ' HD22 ' B' ' 50' ' ' LEU . 54.0 m-85 -101.1 25.92 7.61 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.363 -0.836 . . . . 0.0 110.154 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 50.72 30.62 5.12 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.541 -0.724 . . . . 0.0 110.942 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.431 HD13 HD21 ' B' ' 67' ' ' LEU . 89.1 mt -81.3 114.01 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.283 -0.886 . . . . 0.0 109.857 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.59 168.47 9.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.414 -0.804 . . . . 0.0 110.143 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.9 ptpt -46.5 152.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.595 -0.691 . . . . 0.0 110.943 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 11.3 mt-10 62.99 16.4 9.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.716 -0.615 . . . . 0.0 110.52 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.62 146.04 48.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.28 -0.887 . . . . 0.0 110.223 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 63.2 m -107.55 109.11 20.68 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.329 -0.857 . . . . 0.0 109.977 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.482 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.6 mt -102.43 159.69 15.21 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.334 -0.854 . . . . 0.0 110.189 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.482 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.0 m80 -108.39 137.92 45.55 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.399 -0.813 . . . . 0.0 109.873 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.598 HD23 HG22 ' B' ' 7' ' ' THR . 54.3 tp -107.75 133.89 51.5 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.179 -0.951 . . . . 0.0 110.646 -179.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.57 HG13 ' HB3' ' A' ' 92' ' ' GLN . 38.6 t -124.73 157.51 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.461 -0.774 . . . . 0.0 109.56 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -93.22 131.8 37.98 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.14 -0.975 . . . . 0.0 110.227 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 1.8 tmt_? -112.34 157.52 20.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 14.0 mt -122.12 156.06 34.41 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 110.141 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.83 156.38 43.53 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.337 -0.852 . . . . 0.0 110.248 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.2 -48.89 1.93 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 CA-C-O 118.001 -1.444 . . . . 0.0 109.572 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.194 0.521 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttp -88.54 -177.06 5.51 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.384 -0.822 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.77 25.5 11.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.437 -0.79 . . . . 0.0 109.538 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.44 64.8 4.12 Favored Glycine 0 N--CA 1.489 2.184 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mt -139.21 60.38 1.59 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.29 -1.124 . . . . 0.0 110.273 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -72.72 -128.38 0.1 Allowed Glycine 0 N--CA 1.492 2.382 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.01 -46.1 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.397 -1.061 . . . . 0.0 110.185 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.9 p -63.37 -27.37 69.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.35 -0.844 . . . . 0.0 110.175 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.1 -11.48 60.32 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.377 -0.827 . . . . 0.0 110.49 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' HB3' HG21 ' A' ' 14' ' ' VAL . 63.9 m-85 -139.56 95.14 2.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.162 -0.961 . . . . 0.0 110.313 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -168.22 34.21 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.343 -0.848 . . . . 0.0 110.236 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.32 -44.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.455 -0.778 . . . . 0.0 110.077 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -106.75 29.01 11.47 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 10' ' ' PHE . 76.6 t -106.47 -62.26 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.401 -1.058 . . . . 0.0 110.062 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -168.18 163.34 8.83 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.351 -0.843 . . . . 0.0 110.137 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.4 -19.5 28.73 Favored 'Trans proline' 0 C--N 1.309 -1.515 0 O-C-N 123.772 1.406 . . . . 0.0 110.677 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t -66.49 -13.9 61.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.336 -0.852 . . . . 0.0 110.512 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.46 -15.27 62.47 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.251 -0.906 . . . . 0.0 110.48 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -168.88 118.7 0.61 Allowed Pre-proline 0 N--CA 1.489 1.522 0 O-C-N 121.267 -0.895 . . . . 0.0 109.902 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -70.07 -14.73 35.44 Favored 'Trans proline' 0 C--N 1.306 -1.669 0 O-C-N 123.931 1.49 . . . . 0.0 110.206 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -75.73 -31.83 59.77 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.467 -0.77 . . . . 0.0 109.398 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' HA ' HD23 ' A' ' 22' ' ' LEU . 50.1 mt -87.48 -28.51 22.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.672 -0.642 . . . . 0.0 109.411 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -71.47 -39.99 70.55 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.452 -0.78 . . . . 0.0 109.489 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.74 ' O ' HG23 ' A' ' 28' ' ' VAL . 5.5 mt -77.56 -32.08 53.58 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.526 -0.734 . . . . 0.0 109.705 179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.51 -36.07 83.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.71 -21.99 40.73 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.432 -0.792 . . . . 0.0 110.122 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.4 ttt-85 -84.93 -27.43 26.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.347 -0.846 . . . . 0.0 109.737 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.3 t -80.32 -36.02 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.401 -0.812 . . . . 0.0 109.901 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.2 t -73.55 -44.6 57.11 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 109.991 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.0 mmt -65.81 -30.55 71.2 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.373 -0.83 . . . . 0.0 109.978 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -76.96 -39.35 50.91 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.372 -0.83 . . . . 0.0 110.045 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.05 -44.1 90.12 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.942 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.33 -46.35 89.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.348 -0.845 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -62.59 -38.96 92.17 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.422 -0.799 . . . . 0.0 110.041 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -39.22 80.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.084 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.92 -42.44 27.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.412 -0.805 . . . . 0.0 109.998 179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -69.67 -24.43 63.61 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.434 -0.791 . . . . 0.0 109.934 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -83.82 -57.43 3.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.458 -0.776 . . . . 0.0 109.529 179.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -51.83 -32.59 32.3 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.487 -0.758 . . . . 0.0 109.332 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -84.62 -34.62 23.08 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.26 -51.14 65.07 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.456 -0.777 . . . . 0.0 109.738 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.514 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 24.3 ptt180 -69.69 -31.78 70.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.418 -0.801 . . . . 0.0 109.723 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.75 -41.27 63.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.412 -0.805 . . . . 0.0 109.24 179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.13 -24.99 34.78 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.56 -0.713 . . . . 0.0 109.155 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.514 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -69.69 -27.87 65.37 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.492 -0.755 . . . . 0.0 109.977 179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -91.28 -42.13 10.56 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.45 -0.782 . . . . 0.0 110.227 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.95 -28.61 69.94 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.442 -0.787 . . . . 0.0 110.151 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 39.7 m -89.64 -34.08 16.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.275 -0.89 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.92 -30.67 65.59 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.347 -0.846 . . . . 0.0 110.238 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.65 -26.94 65.58 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.348 -0.845 . . . . 0.0 110.162 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.68 -28.45 67.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.331 -0.856 . . . . 0.0 110.173 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -122.62 21.16 10.17 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.458 -0.776 . . . . 0.0 110.22 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.444 ' C ' HG23 ' A' ' 54' ' ' ILE . . . -127.35 -56.28 0.13 Allowed Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.481 ' O ' HD12 ' A' ' 54' ' ' ILE . 1.1 pp -148.39 80.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.274 -1.133 . . . . 0.0 110.273 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -98.5 121.41 40.41 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.29 -0.881 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 3.2 m -77.31 89.78 3.74 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.411 -0.805 . . . . 0.0 110.131 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 4.4 m -77.62 97.46 5.1 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.31 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -137.21 -116.51 1.52 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.633 HG23 ' O ' ' A' ' 59' ' ' THR . 5.5 t -165.88 102.86 0.67 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.381 -1.07 . . . . 0.0 110.224 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -118.39 90.43 3.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.316 -0.865 . . . . 0.0 110.131 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -80.95 -42.49 21.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.383 -0.823 . . . . 0.0 110.262 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.471 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 17.0 m -122.96 81.63 1.89 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.363 -0.836 . . . . 0.0 110.261 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.31 -31.62 71.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.305 -0.872 . . . . 0.0 110.111 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -76.12 -29.64 57.92 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.289 -0.882 . . . . 0.0 109.215 179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.34 -36.07 81.05 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.449 -0.901 . . . . 0.0 108.7 179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tt -71.23 -31.02 67.06 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 2.4 tt -76.15 -38.7 56.37 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.537 -0.727 . . . . 0.0 109.737 179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -82.08 -52.73 6.72 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.441 -0.787 . . . . 0.0 110.305 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 ttt -54.34 -39.11 66.79 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.201 -0.937 . . . . 0.0 110.463 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 55.2 m -70.12 -40.7 74.69 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.326 -0.859 . . . . 0.0 110.346 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.405 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.9 tp -84.6 -13.23 11.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.22 -0.925 . . . . 0.0 110.32 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 68' ' ' LYS . 87.7 p -79.84 -29.15 40.04 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.189 -0.944 . . . . 0.0 109.923 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -94.34 -25.97 16.76 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.163 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -97.46 -27.47 14.42 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.348 -0.845 . . . . 0.0 110.273 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -112.81 -22.22 10.78 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.276 -0.89 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.591 ' CE1' HG21 ' A' ' 79' ' ' THR . 51.0 t80 52.91 58.32 5.46 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.209 -0.932 . . . . 0.0 110.436 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -86.68 -54.61 2.61 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.34 117.5 32.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -1.083 . . . . 0.0 110.155 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.591 HG21 ' CE1' ' A' ' 76' ' ' PHE . 3.0 m -153.38 31.69 0.47 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.422 -0.799 . . . . 0.0 110.313 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -98.66 36.1 4.22 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -175.08 153.06 1.54 Allowed Pre-proline 0 N--CA 1.489 1.514 0 O-C-N 121.411 -1.052 . . . . 0.0 108.909 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -76.71 38.45 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 123.539 1.284 . . . . 0.0 110.965 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.7 91.67 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.057 -1.027 . . . . 0.0 110.655 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -86.1 -29.91 22.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.415 -0.803 . . . . 0.0 110.073 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -65.18 -15.88 62.92 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.295 -0.878 . . . . 0.0 110.359 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 73.2 m -90.68 -22.87 20.93 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.272 -0.893 . . . . 0.0 110.085 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 8.7 mtt -88.47 123.93 33.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.376 -0.828 . . . . 0.0 110.071 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 76.5 p -78.29 -164.49 0.56 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.293 -0.879 . . . . 0.0 110.36 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.482 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.6 pt-20 -67.25 -31.3 71.55 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.439 -0.788 . . . . 0.0 109.393 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.525 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 21.6 mt-10 -85.47 -40.22 16.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 2.7 tp10 -63.39 -45.08 92.75 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.577 ' HB3' HG13 ' B' ' 70' ' ' VAL . 36.7 mt-30 -67.28 -34.52 77.57 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.525 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -59.6 -39.24 78.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -58.53 -34.71 71.29 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.72 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.5 t80 -62.03 -41.11 97.75 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.336 0.588 . . . . 0.0 109.543 179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.441 ' HB2' ' CG2' ' B' ' 70' ' ' VAL . . . -77.62 -36.91 51.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.529 -0.732 . . . . 0.0 109.989 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 ttm -76.35 -23.52 54.21 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.269 -0.894 . . . . 0.0 109.529 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.5 tp-100 -79.84 -26.17 40.53 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.495 -0.753 . . . . 0.0 110.034 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 23.1 ttp -96.09 -8.03 34.48 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.371 -0.831 . . . . 0.0 110.435 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.466 ' HB2' ' CD2' ' B' ' 68' ' ' HIS . 1.3 t -100.01 -21.85 15.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.254 -0.904 . . . . 0.0 110.433 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.25 -19.46 45.99 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.254 -0.904 . . . . 0.0 110.14 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -98.91 51.02 0.96 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.327 -0.858 . . . . 0.0 110.235 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -64.22 -109.36 0.01 OUTLIER Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -89.78 84.47 6.27 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.383 -1.069 . . . . 0.0 110.2 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -75.6 -74.71 0.2 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -168.97 -58.43 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.364 -0.835 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 135.23 -32.15 2.6 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.509 -1.437 . . . . 0.0 109.509 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -100.68 65.23 1.14 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.43 -1.041 . . . . 0.0 110.251 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.26 70.14 0.1 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.39 -0.818 . . . . 0.0 110.226 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 53.03 30.83 10.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.304 -0.872 . . . . 0.0 110.482 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.1 t -107.5 -36.11 6.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.414 -0.804 . . . . 0.0 110.182 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.192 -179.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.1 ttp . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.261 0.553 . . . . 0.0 110.393 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -92.48 140.86 29.14 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.395 -0.816 . . . . 0.0 109.76 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 24.1 pt -137.47 159.01 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.872 . . . . 0.0 110.383 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -111.96 142.49 44.29 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.63 -0.669 . . . . 0.0 110.805 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 59.0 t -128.09 120.26 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 109.481 179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.602 ' HG3' HG23 ' B' ' 12' ' ' THR . 4.5 mtpp -99.93 133.91 43.6 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.353 -179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 69.5 p -95.74 175.66 6.44 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.399 -0.813 . . . . 0.0 110.397 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.72 HD23 ' CD2' ' A' ' 95' ' ' TYR . 6.1 mt -61.93 -10.2 8.95 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.429 -0.795 . . . . 0.0 111.116 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 72.7 p -95.48 3.55 54.12 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.963 -1.085 . . . . 0.0 110.875 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 84.08 2.84 89.34 Favored Glycine 0 N--CA 1.493 2.46 0 C-N-CA 119.982 -1.104 . . . . 0.0 110.372 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 19.3 tttt -84.56 133.32 34.45 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.034 -1.274 . . . . 0.0 109.979 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.602 HG23 ' HG3' ' B' ' 6' ' ' LYS . 9.4 m -113.32 131.15 56.06 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.302 -0.874 . . . . 0.0 110.274 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 34.1 mt -109.37 140.62 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.429 -0.795 . . . . 0.0 110.384 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 34.2 m -102.03 120.79 40.99 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.365 -0.835 . . . . 0.0 109.421 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.401 HD11 HG12 ' B' ' 30' ' ' ILE . 23.6 mt -123.58 161.16 25.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.147 -0.971 . . . . 0.0 110.894 -179.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -106.4 115.41 30.16 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 109.34 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' B' ' 1' ' ' MET . 32.3 m -140.24 172.62 11.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.261 -0.899 . . . . 0.0 110.955 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.455 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.0 OUTLIER -113.06 165.67 12.7 Favored Pre-proline 0 N--CA 1.489 1.522 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -72.05 -26.36 18.39 Favored 'Trans proline' 0 C--N 1.306 -1.686 0 O-C-N 123.503 1.265 . . . . 0.0 110.207 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 p -84.52 -3.3 58.33 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.185 -0.947 . . . . 0.0 110.477 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -71.41 143.32 50.17 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.952 . . . . 0.0 110.47 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 64.1 p -83.27 156.2 23.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.598 -0.689 . . . . 0.0 110.317 179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 41.9 mm -59.42 -37.02 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.223 -0.923 . . . . 0.0 109.361 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.56 -34.78 73.12 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.484 -0.76 . . . . 0.0 109.272 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -70.44 -32.9 70.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.545 -0.722 . . . . 0.0 109.192 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 60.4 t -69.94 -39.87 78.03 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.437 -0.79 . . . . 0.0 109.102 179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -63.02 -41.95 99.67 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.462 -0.774 . . . . 0.0 109.174 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.44 -34.74 75.92 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.485 -0.759 . . . . 0.0 109.489 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 5.1 mttt -68.32 -38.44 81.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.564 -0.71 . . . . 0.0 109.518 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.526 HD13 HD13 ' B' ' 69' ' ' LEU . 9.1 mt -67.27 -40.42 84.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.372 -0.83 . . . . 0.0 109.208 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.56 -48.04 83.53 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.366 -0.834 . . . . 0.0 109.301 179.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -57.96 -28.25 64.17 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.495 -0.753 . . . . 0.0 110.243 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.4 mmtt -83.49 -42.47 16.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.355 -0.841 . . . . 0.0 110.039 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -108.26 -119.8 0.26 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.553 -0.717 . . . . 0.0 109.719 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.12 20.58 0.25 Allowed Glycine 0 N--CA 1.492 2.383 0 O-C-N 120.78 -1.2 . . . . 0.0 110.202 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.484 HG23 ' HD2' ' B' ' 37' ' ' PRO . 47.7 mt -91.93 143.54 27.89 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.13 -1.217 . . . . 0.0 109.97 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.484 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.5 Cg_endo -68.67 133.66 28.25 Favored 'Trans proline' 0 C--N 1.31 -1.462 0 O-C-N 123.599 1.315 . . . . 0.0 110.243 179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.79 -27.19 84.41 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.63 1.331 . . . . 0.0 110.989 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -68.89 -23.5 64.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.299 -0.875 . . . . 0.0 110.08 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 10.2 mt-30 -101.37 7.11 42.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.256 -0.903 . . . . 0.0 110.503 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -94.44 136.3 34.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.187 -0.945 . . . . 0.0 110.465 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.1 OUTLIER -130.22 128.31 41.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.474 -0.766 . . . . 0.0 109.436 179.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.843 ' HB3' HD12 ' B' ' 50' ' ' LEU . 13.7 mt -104.4 132.48 50.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.731 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.426 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 1.0 OUTLIER -121.31 139.97 46.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.567 -0.708 . . . . 0.0 109.977 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -140.74 135.68 31.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.513 -0.742 . . . . 0.0 110.068 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.39 26.33 0.28 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.526 -0.734 . . . . 0.0 111.585 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.401 ' N ' ' HB3' ' A' ' 100' ' ' SER . . . 86.72 7.67 78.02 Favored Glycine 0 N--CA 1.494 2.534 0 C-N-CA 120.19 -1.005 . . . . 0.0 110.594 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 14.5 mttt -111.11 132.43 54.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -1.219 . . . . 0.0 110.296 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.31 131.31 36.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.832 . . . . 0.0 109.61 179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.843 HD12 ' HB3' ' B' ' 43' ' ' LEU . 29.5 mt -83.72 135.36 34.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.246 -0.909 . . . . 0.0 110.321 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.51 130.43 39.36 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.418 -0.801 . . . . 0.0 110.501 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.459 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.3 m-20 -48.29 -27.13 2.32 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.447 -0.783 . . . . 0.0 111.22 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.91 -10.31 83.18 Favored Glycine 0 N--CA 1.493 2.489 0 C-N-CA 120.171 -1.014 . . . . 0.0 110.623 -179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 7.7 mmt180 -99.48 157.98 16.05 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.991 -1.299 . . . . 0.0 110.554 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 24.7 p -102.27 164.53 11.63 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.36 -0.837 . . . . 0.0 110.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 61' ' ' ILE . 94.3 mt -53.67 -45.66 70.38 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.349 -0.844 . . . . 0.0 110.82 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 31.0 t -56.73 -36.61 69.93 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.378 -0.826 . . . . 0.0 111.134 -179.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -59.51 -27.1 65.87 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.216 -0.927 . . . . 0.0 110.386 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.533 ' CD2' HD22 ' B' ' 50' ' ' LEU . 51.8 m-85 -100.96 24.87 8.7 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.362 -0.836 . . . . 0.0 110.123 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 50.7 31.02 5.4 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.459 -0.775 . . . . 0.0 110.746 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' B' ' 56' ' ' LEU . 81.6 mt -81.39 115.12 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 109.922 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -105.8 170.71 7.74 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.414 -0.804 . . . . 0.0 110.418 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.68 153.59 0.38 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.594 -0.691 . . . . 0.0 111.117 -179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 6.8 mt-10 62.8 17.64 10.05 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.768 -0.583 . . . . 0.0 110.717 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.21 142.3 50.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.239 -0.913 . . . . 0.0 109.958 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.1 m -107.34 106.69 17.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.465 HD21 HD13 ' B' ' 61' ' ' ILE . 1.2 mp -102.4 159.48 15.39 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.297 -0.877 . . . . 0.0 109.79 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.466 ' CD2' ' HB2' ' A' ' 100' ' ' SER . 4.7 m-70 -108.88 143.93 37.46 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.208 -0.932 . . . . 0.0 109.891 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.526 HD13 HD13 ' B' ' 30' ' ' ILE . 1.5 tp -107.4 126.6 52.68 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.392 -0.817 . . . . 0.0 110.622 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.577 HG13 ' HB3' ' A' ' 92' ' ' GLN . 44.0 t -124.67 154.36 32.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.418 -0.801 . . . . 0.0 109.303 179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -94.05 127.84 40.08 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.53 -179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -110.77 105.28 14.08 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.335 -0.853 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mp -103.49 137.14 41.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.368 -0.832 . . . . 0.0 110.241 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 11.0 mtm180 -77.28 75.47 3.84 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.39 -0.819 . . . . 0.0 110.072 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 71.77 -71.4 0.9 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.342 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.533 -179.956 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.2 t60 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.243 0.544 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 52.91 -174.95 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.32 -0.862 . . . . 0.0 110.389 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 3' ' ' LEU . 5.7 mp -112.69 25.85 11.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.335 -0.853 . . . . 0.0 109.618 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -81.0 -35.07 25.32 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.2 79.2 0.7 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.385 -1.068 . . . . 0.0 110.19 -179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -124.91 41.14 1.75 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -83.29 -43.73 15.71 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.421 -1.047 . . . . 0.0 110.177 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.4 t -61.64 -27.68 68.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.345 -0.847 . . . . 0.0 110.143 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -59.04 -28.26 66.26 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.335 -0.853 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.8 m-85 -152.12 78.01 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.424 -0.798 . . . . 0.0 110.175 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -81.77 113.9 20.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.381 -0.824 . . . . 0.0 110.386 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 51.92 29.25 5.88 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.324 -0.86 . . . . 0.0 110.501 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -119.63 25.8 7.51 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.47 HG23 ' OD2' ' A' ' 15' ' ' ASP . 28.9 m -118.76 -20.78 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.288 -1.125 . . . . 0.0 110.525 -179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.47 ' OD2' HG23 ' A' ' 14' ' ' VAL . 33.1 m-20 -125.39 150.43 67.54 Favored Pre-proline 0 N--CA 1.493 1.691 0 O-C-N 121.227 -0.921 . . . . 0.0 110.188 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.65 -20.75 26.31 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.653 1.344 . . . . 0.0 110.744 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 25.7 p -70.48 -5.06 25.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.285 -0.884 . . . . 0.0 110.776 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -131.59 19.23 4.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.1 -1.0 . . . . 0.0 110.221 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -169.66 121.11 0.6 Allowed Pre-proline 0 N--CA 1.488 1.441 0 O-C-N 121.273 -0.892 . . . . 0.0 109.835 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -69.92 -15.25 36.41 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 O-C-N 123.955 1.503 . . . . 0.0 110.154 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -77.08 -29.0 54.8 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 109.54 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.08 -26.0 19.36 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.508 -0.745 . . . . 0.0 109.712 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.84 -41.11 60.51 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.391 -0.818 . . . . 0.0 109.702 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.703 ' O ' HG23 ' A' ' 28' ' ' VAL . 2.4 mt -79.55 -31.48 41.99 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 109.877 179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.79 -37.07 81.55 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.47 -0.769 . . . . 0.0 110.094 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.75 -21.6 40.95 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.358 -0.839 . . . . 0.0 110.326 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.1 -27.47 35.59 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.228 -0.92 . . . . 0.0 109.301 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.703 HG23 ' O ' ' A' ' 24' ' ' LEU . 81.5 t -82.4 -28.11 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 121.605 -0.684 . . . . 0.0 109.828 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -77.23 -37.54 53.09 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.433 -0.792 . . . . 0.0 109.96 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.8 ttt -72.63 -39.82 66.92 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.293 -0.879 . . . . 0.0 110.105 179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -70.8 -30.95 67.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.341 -0.85 . . . . 0.0 109.912 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.413 ' OE2' HG12 ' A' ' 28' ' ' VAL . 5.6 mt-10 -66.48 -52.41 46.48 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.421 -0.8 . . . . 0.0 109.969 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.408 ' HG3' ' N ' ' A' ' 34' ' ' ARG . 11.1 pt20 -60.47 -26.15 66.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.325 -0.86 . . . . 0.0 110.293 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.408 ' N ' ' HG3' ' A' ' 33' ' ' GLN . 0.0 OUTLIER -69.68 -56.77 6.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.312 -0.867 . . . . 0.0 110.019 179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 56.4 mt-30 -58.48 -24.87 61.5 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.42 -0.8 . . . . 0.0 110.001 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -79.5 -42.82 24.41 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.479 -0.763 . . . . 0.0 109.996 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 6.2 mt-30 -78.31 -24.15 46.77 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -84.02 -60.22 2.17 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.404 -0.81 . . . . 0.0 109.627 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 43' ' ' ARG . 7.1 mm-40 -53.14 -30.99 40.1 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.793 . . . . 0.0 109.217 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -82.72 -39.15 22.32 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 120.175 -0.61 . . . . 0.0 109.509 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.486 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.06 -57.13 4.53 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.28 -0.888 . . . . 0.0 110.039 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -39.56 68.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.382 -0.824 . . . . 0.0 110.421 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 39' ' ' GLU . 0.1 OUTLIER -60.15 -37.68 80.85 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.229 -0.919 . . . . 0.0 109.803 179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.95 -30.96 62.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.388 -0.82 . . . . 0.0 109.853 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.16 -29.25 60.39 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.434 -0.791 . . . . 0.0 110.137 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -78.09 -42.83 30.88 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.356 -0.84 . . . . 0.0 110.086 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.4 -38.13 88.45 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.7 t -74.71 -29.31 61.15 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.354 -0.841 . . . . 0.0 110.144 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -70.73 -34.0 71.44 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.378 -0.827 . . . . 0.0 110.016 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -99.69 16.22 24.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.478 -0.763 . . . . 0.0 110.319 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.14 -62.44 1.59 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.221 -0.925 . . . . 0.0 110.07 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.46 22.06 15.51 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.426 -0.796 . . . . 0.0 110.156 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -101.59 -29.68 6.16 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.7 pt -72.28 63.99 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.376 -1.073 . . . . 0.0 110.175 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -165.6 113.63 0.97 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.408 -0.808 . . . . 0.0 110.139 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.402 ' C ' HG23 ' A' ' 57' ' ' THR . 6.3 t -117.13 -170.29 1.81 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.393 -0.817 . . . . 0.0 110.339 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.402 HG23 ' C ' ' A' ' 56' ' ' THR . 31.4 p -148.83 169.58 20.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.301 -0.874 . . . . 0.0 110.167 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -167.1 33.83 0.21 Allowed Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 12.8 m -104.58 79.39 1.55 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.369 -1.077 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -99.58 66.43 1.44 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.34 -0.85 . . . . 0.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -91.91 -35.13 14.2 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 1.4 m -108.2 73.1 0.87 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.381 -0.824 . . . . 0.0 110.111 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -72.08 -40.05 68.52 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.318 -0.864 . . . . 0.0 110.414 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -74.34 -29.53 61.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.154 -0.966 . . . . 0.0 109.132 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.3 -47.58 85.31 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.579 -0.848 . . . . 0.0 108.756 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.412 ' O ' ' CG2' ' A' ' 70' ' ' THR . 1.1 tt -60.76 -29.57 69.48 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.9 tt -78.87 -33.38 45.85 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.66 -0.65 . . . . 0.0 109.829 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -81.65 -54.56 5.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.435 -0.791 . . . . 0.0 110.128 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -39.92 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.24 -0.913 . . . . 0.0 110.666 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.48 HG23 ' N ' ' A' ' 71' ' ' ILE . 13.6 t -68.78 -40.12 79.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.569 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.48 ' N ' HG23 ' A' ' 70' ' ' THR . 5.8 tp -85.52 -15.91 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.125 -0.984 . . . . 0.0 110.378 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 4.8 m -74.47 -36.93 63.33 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.719 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.8 mm100 -87.9 -25.09 23.43 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.497 -0.752 . . . . 0.0 110.04 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.24 -40.88 16.13 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.403 -0.811 . . . . 0.0 110.158 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -75.45 -42.32 53.6 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.297 -0.877 . . . . 0.0 110.224 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -104.05 94.41 5.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.41 -0.806 . . . . 0.0 110.213 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -171.37 86.27 0.08 OUTLIER Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 52.74 95.79 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.387 -1.066 . . . . 0.0 110.471 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -123.44 29.43 6.64 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.359 -0.838 . . . . 0.0 110.193 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.421 ' O ' HD12 ' A' ' 81' ' ' LEU . . . -97.79 31.5 7.81 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.334 -1.506 . . . . 0.0 109.334 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 80' ' ' GLY . 0.2 OUTLIER -163.9 149.77 9.45 Favored Pre-proline 0 N--CA 1.486 1.345 0 O-C-N 121.54 -0.976 . . . . 0.0 108.689 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -76.93 38.45 0.64 Allowed 'Trans proline' 0 C--N 1.304 -1.806 0 O-C-N 123.511 1.269 . . . . 0.0 110.912 -179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.06 44.96 28.41 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.147 -0.971 . . . . 0.0 110.629 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.664 HD21 HD13 ' B' ' 8' ' ' LEU . 3.9 mt -62.44 -49.99 73.26 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.31 -0.869 . . . . 0.0 110.098 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 71.7 m -71.88 -11.87 61.0 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.341 -0.85 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 8.1 t -102.04 -18.88 15.41 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.245 -0.909 . . . . 0.0 109.944 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 13.3 mtm -81.42 -162.83 0.55 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.404 -0.81 . . . . 0.0 109.845 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 71.9 p -144.49 -173.54 4.07 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.302 -0.874 . . . . 0.0 110.344 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.567 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 8.9 pt-20 -64.71 -33.1 75.15 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.516 -0.74 . . . . 0.0 109.323 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.468 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 10.2 mt-10 -85.29 -41.74 15.26 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.556 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -63.58 -44.89 92.74 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.721 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.7 mt-30 -67.42 -34.12 76.57 Favored 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 178.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.567 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -59.77 -39.23 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.163 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.06 -33.25 70.57 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.455 ' CE2' ' HA ' ' B' ' 8' ' ' LEU . 22.0 t80 -65.34 -33.78 76.77 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 178.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.77 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -79.04 -37.56 38.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.704 -0.622 . . . . 0.0 109.771 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.475 ' O ' HD12 ' A' ' 101' ' ' LEU . 37.0 mtt -80.32 -21.26 42.72 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.442 -0.786 . . . . 0.0 109.92 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 57.6 mt-30 -80.6 -39.26 27.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.325 -0.86 . . . . 0.0 110.276 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 28.3 mmm -83.91 -26.76 29.08 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.382 -0.824 . . . . 0.0 110.408 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 59.6 m -77.14 -33.91 56.64 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.281 -0.887 . . . . 0.0 110.259 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 97' ' ' MET . 28.2 mt -63.77 -21.23 66.31 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.291 -0.88 . . . . 0.0 110.34 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -155.92 50.87 0.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.346 -0.846 . . . . 0.0 110.165 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -110.66 69.49 0.21 Allowed Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.515 -1.434 . . . . 0.0 109.515 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.73 99.44 0.89 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.358 -1.084 . . . . 0.0 110.229 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -104.35 -64.94 1.06 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.449 -0.782 . . . . 0.0 110.248 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.27 87.63 1.4 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.281 -0.887 . . . . 0.0 110.193 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -102.42 -34.94 4.0 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -87.11 53.77 2.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.331 -1.099 . . . . 0.0 110.154 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -87.19 -47.55 8.77 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.328 -0.858 . . . . 0.0 110.14 179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -121.1 -52.13 2.09 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.372 -0.83 . . . . 0.0 110.086 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 79.7 p -88.88 138.41 31.44 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.28 -0.887 . . . . 0.0 110.278 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.178 -179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.459 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 48.8 ttp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.17 0.51 . . . . 0.0 110.418 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -92.34 141.43 28.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.435 -0.791 . . . . 0.0 109.731 179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 36.6 pt -137.48 158.55 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.598 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -112.04 143.4 43.11 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.66 -0.65 . . . . 0.0 110.737 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.412 ' O ' ' HA ' ' B' ' 12' ' ' THR . 85.4 t -128.18 123.19 59.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.416 -0.802 . . . . 0.0 109.584 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.8 OUTLIER -99.89 137.58 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.345 -0.847 . . . . 0.0 110.592 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 39.9 p -96.24 171.68 8.44 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.525 -0.734 . . . . 0.0 110.419 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.664 HD13 HD21 ' A' ' 84' ' ' LEU . 1.0 OUTLIER -61.91 -12.05 16.08 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.397 -0.814 . . . . 0.0 110.999 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.0 p -95.44 -18.25 20.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.032 -1.042 . . . . 0.0 110.62 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.55 8.72 24.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.437 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 2.0 tttp -84.55 133.9 34.43 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.064 -1.257 . . . . 0.0 109.89 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.412 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 19.2 m -113.1 126.9 55.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.287 -0.883 . . . . 0.0 110.214 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 26.7 mt -109.23 137.17 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.442 -0.786 . . . . 0.0 110.309 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 17.4 m -102.21 120.82 41.1 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.502 -0.749 . . . . 0.0 109.367 179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.562 HD11 HG12 ' B' ' 30' ' ' ILE . 83.4 mt -123.39 159.91 27.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.178 -0.951 . . . . 0.0 110.984 -179.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -106.3 113.96 27.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.508 -0.745 . . . . 0.0 109.279 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.573 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.8 m -140.19 173.33 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 110.973 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -113.26 164.16 16.35 Favored Pre-proline 0 N--CA 1.488 1.455 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -71.17 -24.79 23.04 Favored 'Trans proline' 0 C--N 1.306 -1.696 0 O-C-N 123.448 1.236 . . . . 0.0 110.162 179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -84.46 -4.38 58.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.202 -0.936 . . . . 0.0 110.411 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -71.35 144.11 50.0 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.234 -0.916 . . . . 0.0 110.557 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.6 p -83.33 157.72 22.47 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.577 -0.702 . . . . 0.0 110.362 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 43.9 mm -59.59 -36.68 66.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 O-C-N 121.267 -0.896 . . . . 0.0 109.414 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -59.78 -36.07 75.94 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.474 -0.766 . . . . 0.0 109.36 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -70.53 -31.48 68.56 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.554 -0.716 . . . . 0.0 109.33 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.2 t -70.01 -41.85 79.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.516 -0.74 . . . . 0.0 109.174 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -62.86 -41.5 99.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.431 -0.793 . . . . 0.0 109.076 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.45 -34.07 74.8 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.572 -0.705 . . . . 0.0 109.294 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.573 ' CD ' HG12 ' B' ' 17' ' ' VAL . 39.0 mttm -68.25 -38.22 81.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.538 -0.726 . . . . 0.0 109.376 179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.562 HG12 HD11 ' B' ' 15' ' ' LEU . 10.8 mt -67.16 -38.73 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.289 -0.882 . . . . 0.0 109.019 179.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -60.57 -49.99 75.32 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.405 -0.809 . . . . 0.0 109.409 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -57.9 -27.14 63.04 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.59 -0.694 . . . . 0.0 110.304 179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 4.9 mmtm -83.57 -45.06 13.95 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -108.24 -116.58 0.27 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.442 -0.786 . . . . 0.0 109.831 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -160.25 22.0 0.25 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.103 -1.199 . . . . 0.0 110.103 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -91.99 139.78 24.57 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.121 -1.223 . . . . 0.0 110.038 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.8 Cg_endo -71.19 138.55 33.56 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 O-C-N 123.688 1.362 . . . . 0.0 110.254 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.94 -29.26 87.68 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.668 1.352 . . . . 0.0 110.987 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.04 -24.73 64.22 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.329 -0.857 . . . . 0.0 110.302 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.489 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 67.8 mm-40 -101.31 3.94 41.16 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.382 -0.824 . . . . 0.0 110.644 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -94.29 138.87 31.78 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.192 -0.942 . . . . 0.0 110.5 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.0 mtt85 -130.26 129.47 43.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.437 -0.789 . . . . 0.0 109.679 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.908 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.9 mt -104.7 126.66 52.0 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.276 -0.89 . . . . 0.0 110.617 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.77 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.8 mp -121.5 138.44 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.609 -0.682 . . . . 0.0 109.857 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -140.95 137.65 33.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.364 -0.835 . . . . 0.0 110.074 179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.26 28.28 0.42 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.5 -0.75 . . . . 0.0 111.477 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.84 4.3 87.34 Favored Glycine 0 N--CA 1.495 2.57 0 C-N-CA 120.163 -1.018 . . . . 0.0 110.68 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -110.92 128.01 55.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.996 -1.296 . . . . 0.0 110.234 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.08 134.29 37.75 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.251 -0.905 . . . . 0.0 109.684 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.908 HD12 ' HB3' ' B' ' 43' ' ' LEU . 60.7 mt -83.86 137.76 33.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.395 -0.816 . . . . 0.0 110.438 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -93.69 131.12 39.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.37 -0.831 . . . . 0.0 110.374 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.423 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 56.5 m-20 -48.38 -27.11 2.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.523 -0.736 . . . . 0.0 111.183 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.84 -9.58 84.28 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.486 -1.046 . . . . 0.0 110.486 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.41 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 31.1 mmt-85 -99.51 157.24 16.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.092 -1.24 . . . . 0.0 110.522 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.561 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 17.1 p -102.69 163.83 11.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.234 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' B' ' 61' ' ' ILE . 59.0 mt -53.49 -44.34 68.95 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.82 . . . . 0.0 110.686 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -56.6 -36.24 69.19 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.38 -0.825 . . . . 0.0 110.988 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -59.68 -26.79 65.86 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.19 -0.944 . . . . 0.0 110.389 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.71 ' CD2' HD22 ' B' ' 50' ' ' LEU . 79.5 m-85 -100.95 23.33 10.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.284 -0.885 . . . . 0.0 110.424 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.67 30.24 4.77 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.334 -0.854 . . . . 0.0 110.735 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' B' ' 56' ' ' LEU . 92.2 mt -81.34 114.53 22.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.289 -0.882 . . . . 0.0 109.904 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -105.65 171.83 7.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.277 -0.89 . . . . 0.0 110.474 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.69 153.31 0.4 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.583 -0.698 . . . . 0.0 111.198 -179.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 2.9 mt-10 62.93 17.89 10.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.785 -0.572 . . . . 0.0 110.743 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.36 143.43 50.22 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.291 -0.881 . . . . 0.0 110.003 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 87.6 m -107.44 107.15 17.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.296 -0.878 . . . . 0.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 2.1 mt -102.74 160.13 14.86 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.322 -0.862 . . . . 0.0 110.172 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -108.87 136.13 48.93 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.279 -0.888 . . . . 0.0 109.594 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 24.2 tp -107.15 132.19 53.3 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.191 -0.943 . . . . 0.0 110.834 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.721 HG13 ' HB3' ' A' ' 92' ' ' GLN . 84.5 t -125.07 155.86 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.449 -0.782 . . . . 0.0 110.184 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.76 120.27 34.71 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.436 -0.79 . . . . 0.0 110.254 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.422 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 0.3 OUTLIER -91.24 70.71 6.17 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.08 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.45 119.49 13.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.34 -0.85 . . . . 0.0 110.247 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -111.14 150.2 29.79 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.398 -0.814 . . . . 0.0 110.287 179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 74.83 -93.35 0.84 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 CA-C-O 118.022 -1.432 . . . . 0.0 109.547 179.958 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.219 0.533 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.26 -178.5 3.67 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.313 -0.867 . . . . 0.0 110.281 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 3' ' ' LEU . 1.5 mm? -111.88 24.23 12.91 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.496 -0.753 . . . . 0.0 109.577 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.35 -48.02 4.16 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 tt -167.28 104.13 0.53 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.339 -1.095 . . . . 0.0 110.176 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -153.76 -77.05 0.02 OUTLIER Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -116.73 51.45 0.99 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.345 -1.091 . . . . 0.0 110.293 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 m -154.98 26.41 0.43 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.419 -0.801 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -111.83 -11.53 13.92 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.37 -0.831 . . . . 0.0 110.431 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -166.95 37.24 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.275 -0.89 . . . . 0.0 110.348 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -79.07 60.01 2.85 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.38 -0.825 . . . . 0.0 110.251 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -169.44 -57.46 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.338 -0.851 . . . . 0.0 110.209 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -109.88 49.2 0.87 Allowed Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 p -117.43 -24.63 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.404 -1.056 . . . . 0.0 110.402 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -138.91 148.78 59.31 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.307 -0.871 . . . . 0.0 110.07 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.82 -15.41 29.83 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.696 1.367 . . . . 0.0 110.732 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 54.0 p -72.9 -6.81 47.63 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.146 -0.971 . . . . 0.0 110.66 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -115.65 17.51 16.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.026 -1.046 . . . . 0.0 110.409 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.67 119.96 0.58 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.794 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.96 -14.55 35.61 Favored 'Trans proline' 0 C--N 1.305 -1.743 0 O-C-N 123.896 1.472 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -78.37 -31.76 48.6 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.282 -0.886 . . . . 0.0 109.488 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mp -90.75 -27.03 19.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.542 -0.724 . . . . 0.0 109.517 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.87 -41.23 64.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.458 -0.776 . . . . 0.0 109.597 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.7 tp -78.17 -32.69 50.26 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.461 -0.774 . . . . 0.0 109.736 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.4 -33.85 76.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.457 -0.777 . . . . 0.0 109.77 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.13 -21.71 36.51 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.488 -0.757 . . . . 0.0 110.086 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.04 -26.05 27.27 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.33 -0.857 . . . . 0.0 109.784 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 24' ' ' LEU . 59.9 t -83.87 -31.44 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.464 -0.773 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.5 m -79.84 -37.8 34.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.392 -0.817 . . . . 0.0 110.185 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.3 ttt -72.46 -34.25 67.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.34 -0.85 . . . . 0.0 110.236 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -74.37 -32.92 62.93 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.334 -0.854 . . . . 0.0 110.092 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -75.53 -44.47 43.39 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.39 -0.819 . . . . 0.0 110.094 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.19 -36.25 83.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.403 -0.81 . . . . 0.0 110.071 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -66.56 -43.13 85.88 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.423 -0.798 . . . . 0.0 110.12 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -34.33 70.27 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.368 -0.832 . . . . 0.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.19 -37.58 37.93 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.425 -0.797 . . . . 0.0 109.957 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.654 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.55 -27.57 60.57 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.397 -0.814 . . . . 0.0 110.079 179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -83.75 -58.98 2.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.45 -0.781 . . . . 0.0 109.719 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -51.28 -31.83 22.55 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.402 -0.811 . . . . 0.0 109.33 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.45 -35.45 23.02 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.654 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.5 -50.94 65.43 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.812 -0.755 . . . . 0.0 109.763 179.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -69.65 -30.98 68.8 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.363 -0.835 . . . . 0.0 109.748 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 mtt180 -54.63 -38.69 67.16 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.398 -0.814 . . . . 0.0 109.287 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -78.86 -28.08 44.15 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.616 -0.678 . . . . 0.0 109.209 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.6 -27.59 68.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.575 -0.703 . . . . 0.0 109.841 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.56 -41.37 14.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.448 -0.782 . . . . 0.0 110.152 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.72 -29.86 70.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.342 -0.849 . . . . 0.0 110.11 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.18 -40.17 17.0 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.378 -0.827 . . . . 0.0 110.139 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -61.79 -21.98 65.06 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.333 -0.855 . . . . 0.0 110.32 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.71 -12.29 61.25 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.897 . . . . 0.0 110.564 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.38 -51.06 66.01 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.2 -0.937 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.48 22.8 11.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.41 -0.806 . . . . 0.0 110.287 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -111.32 -67.27 0.54 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.576 HG23 ' O ' ' A' ' 54' ' ' ILE . 2.6 tp -102.76 58.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.337 -1.096 . . . . 0.0 110.185 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -120.45 -36.27 3.24 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.356 -0.84 . . . . 0.0 110.15 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 20.4 p -120.04 127.98 53.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.356 -0.84 . . . . 0.0 110.169 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 63.2 m -117.74 90.77 3.4 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.321 -0.862 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -166.65 40.38 0.25 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 6.8 m -111.03 58.8 0.61 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.407 -1.055 . . . . 0.0 110.182 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -110.65 81.72 1.48 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.327 -0.858 . . . . 0.0 110.19 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -114.51 -41.49 3.43 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.342 -0.849 . . . . 0.0 110.175 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 24.6 m -124.79 87.21 2.68 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.382 -0.824 . . . . 0.0 110.174 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.36 -29.74 66.23 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.251 -0.905 . . . . 0.0 110.233 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -76.04 -29.31 58.02 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.233 -0.917 . . . . 0.0 109.063 179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.54 -41.52 98.93 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.763 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.25 -30.08 70.45 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 178.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.89 -38.63 57.62 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.612 -0.68 . . . . 0.0 109.755 179.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -80.31 -54.69 5.49 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.426 -0.796 . . . . 0.0 110.144 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.27 -38.61 53.69 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.176 -0.952 . . . . 0.0 110.542 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 56.4 m -70.19 -41.77 73.28 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.403 -0.811 . . . . 0.0 110.427 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.411 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.1 tp -84.37 -12.76 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.185 -0.947 . . . . 0.0 110.388 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.4 p -76.86 -47.36 21.53 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.262 -0.899 . . . . 0.0 109.682 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -78.85 -25.32 44.02 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.395 -0.816 . . . . 0.0 110.001 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -81.66 -48.47 11.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.417 -0.802 . . . . 0.0 110.218 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.29 -45.43 94.51 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.324 -0.86 . . . . 0.0 110.103 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -88.51 106.6 18.39 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.428 -0.795 . . . . 0.0 110.211 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -153.4 -60.39 0.01 OUTLIER Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.54 -1.424 . . . . 0.0 109.54 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.5 ttt85 -97.8 118.9 35.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.403 -1.057 . . . . 0.0 110.216 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.9 m -153.36 45.83 0.65 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.395 -0.815 . . . . 0.0 110.24 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -91.07 60.89 3.02 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 1.1 pp -172.54 147.47 1.7 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.31 -1.112 . . . . 0.0 108.886 179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -71.09 64.24 2.59 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.599 1.315 . . . . 0.0 110.286 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -52.88 99.56 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.415 -0.803 . . . . 0.0 110.416 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.509 ' CD2' HD22 ' B' ' 8' ' ' LEU . 1.9 mp -76.8 -35.03 57.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.167 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.8 m -62.03 -17.99 59.1 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.337 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.9 m -107.71 -22.45 12.48 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.271 -0.893 . . . . 0.0 110.156 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 6.4 mtp -63.36 -165.09 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.357 -0.84 . . . . 0.0 110.007 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 78.8 p -141.43 -175.11 4.23 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.322 -0.861 . . . . 0.0 110.45 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.546 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 16.7 pt-20 -66.07 -31.37 72.21 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.558 -0.714 . . . . 0.0 109.295 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.491 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 58.2 mt-10 -83.23 -42.0 17.73 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 179.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -63.32 -43.88 96.52 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.657 ' HB3' HG13 ' B' ' 70' ' ' VAL . 80.0 mt-30 -67.27 -34.14 76.78 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.546 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -62.63 -39.8 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -57.27 -31.93 66.09 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.545 ' CD2' HD23 ' B' ' 8' ' ' LEU . 19.7 t80 -70.7 -50.86 31.95 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.387 0.613 . . . . 0.0 109.707 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.66 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -65.42 -32.1 73.54 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.538 -0.726 . . . . 0.0 110.207 179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 19.0 mtt -81.34 -24.04 37.36 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.238 -0.914 . . . . 0.0 109.948 179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -80.43 -26.27 38.51 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.366 -0.834 . . . . 0.0 110.433 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -91.73 -21.76 20.55 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.387 -0.821 . . . . 0.0 110.495 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 50.8 p -87.12 -23.57 24.83 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.375 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 101' ' ' LEU . 12.1 tp -83.69 3.36 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.334 -0.853 . . . . 0.0 110.708 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -159.53 27.13 0.19 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.203 -0.936 . . . . 0.0 110.31 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -83.72 -48.82 5.09 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.525 -1.43 . . . . 0.0 109.525 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -124.54 69.49 1.1 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.365 -1.08 . . . . 0.0 110.166 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 52.88 86.24 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.374 -0.828 . . . . 0.0 110.386 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -148.89 44.63 1.0 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.862 . . . . 0.0 110.214 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.58 39.79 2.63 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -128.8 102.64 6.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -1.064 . . . . 0.0 110.15 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -98.9 -17.44 18.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.414 -0.804 . . . . 0.0 110.414 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -92.02 44.93 1.19 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.251 -0.906 . . . . 0.0 110.368 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 2.7 t -169.44 -62.15 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.383 -0.823 . . . . 0.0 110.178 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.199 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.454 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.8 ttp . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.298 0.57 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -117.48 139.87 50.35 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.419 -0.8 . . . . 0.0 109.689 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.54 HD13 HG21 ' B' ' 17' ' ' VAL . 46.0 pt -137.33 159.32 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.311 -0.868 . . . . 0.0 110.177 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -111.92 147.78 35.12 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.463 -0.773 . . . . 0.0 110.706 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 19.3 t -127.64 119.82 52.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.427 -0.796 . . . . 0.0 109.486 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -99.88 127.2 46.08 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.061 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 82.1 p -95.56 173.13 7.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.338 -0.851 . . . . 0.0 110.277 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.545 HD23 ' CD2' ' A' ' 95' ' ' TYR . 7.1 mt -61.75 -10.15 8.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.422 -0.799 . . . . 0.0 111.036 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.9 p -95.37 11.89 31.12 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.038 -1.039 . . . . 0.0 110.598 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.0 6.19 72.76 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 110.399 -1.081 . . . . 0.0 110.399 179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . . . . . . . . . 42.0 tttm -84.89 136.2 33.74 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.999 -1.295 . . . . 0.0 110.212 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 59.3 m -113.67 127.58 56.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 110.061 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.556 HD11 ' OE2' ' B' ' 34' ' ' GLU . 0.9 OUTLIER -109.69 141.85 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 O-C-N 121.331 -0.856 . . . . 0.0 110.321 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.775 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.3 m -102.02 123.87 46.65 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.471 -0.768 . . . . 0.0 109.422 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.775 HD12 ' C ' ' B' ' 14' ' ' THR . 10.3 mp -123.19 155.64 36.7 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.171 -0.956 . . . . 0.0 110.781 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -106.4 114.06 27.96 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.354 -0.841 . . . . 0.0 109.503 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.54 HG21 HD13 ' B' ' 3' ' ' ILE . 35.4 m -140.2 177.51 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.239 -0.913 . . . . 0.0 110.886 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.706 ' O ' HD12 ' B' ' 56' ' ' LEU . 14.4 mt-10 -113.21 165.3 13.54 Favored Pre-proline 0 N--CA 1.488 1.452 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.08 -27.78 16.67 Favored 'Trans proline' 0 C--N 1.306 -1.672 0 O-C-N 123.489 1.258 . . . . 0.0 110.35 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.8 p -84.59 -2.74 57.86 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.217 -0.927 . . . . 0.0 110.486 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -71.27 144.24 50.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.231 -0.918 . . . . 0.0 110.394 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 40.3 p -83.2 157.6 22.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.535 -0.728 . . . . 0.0 110.386 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.45 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 47.1 mm -59.75 -33.31 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.317 -0.865 . . . . 0.0 109.577 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -62.29 -37.73 86.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.446 -0.784 . . . . 0.0 109.413 179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.28 -31.8 69.31 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.518 -0.739 . . . . 0.0 109.276 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 65.4 t -69.98 -41.97 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 119.86 -0.736 . . . . 0.0 109.218 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -63.03 -39.95 96.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.421 -0.799 . . . . 0.0 109.209 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.34 -37.92 85.04 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.478 -0.764 . . . . 0.0 109.342 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.504 ' HB3' HD23 ' B' ' 15' ' ' LEU . 12.2 mttp -67.85 -33.26 74.42 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.845 -0.742 . . . . 0.0 109.22 179.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.459 HD13 HD13 ' B' ' 69' ' ' LEU . 16.6 mt -67.57 -41.01 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.411 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.6 OUTLIER -60.37 -49.47 77.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.395 -0.816 . . . . 0.0 109.465 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -58.11 -26.97 63.28 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.383 -0.823 . . . . 0.0 110.251 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -84.0 -40.97 17.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.333 -0.854 . . . . 0.0 110.789 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . 0.556 ' OE2' HD11 ' B' ' 13' ' ' ILE . 7.0 mt-10 -108.04 -54.45 2.5 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.305 -0.872 . . . . 0.0 110.565 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.411 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 125.52 18.86 2.4 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.522 HG23 ' HD2' ' B' ' 37' ' ' PRO . 30.8 mt -91.41 144.8 30.23 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.165 -1.197 . . . . 0.0 109.874 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.522 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.3 Cg_endo -67.67 132.13 26.13 Favored 'Trans proline' 0 C--N 1.31 -1.478 0 O-C-N 123.636 1.335 . . . . 0.0 110.428 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.8 -25.33 80.97 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.738 1.389 . . . . 0.0 110.899 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.87 -25.5 64.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.328 -0.858 . . . . 0.0 109.96 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.421 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.1 mm-40 -101.32 4.1 41.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 110.478 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -94.35 136.69 34.36 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.199 -0.938 . . . . 0.0 110.414 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.02 128.96 43.05 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.388 -0.82 . . . . 0.0 109.517 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.799 ' HB3' HD12 ' B' ' 50' ' ' LEU . 16.9 mt -104.43 128.52 52.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.182 -0.949 . . . . 0.0 110.943 -179.348 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -120.99 135.62 60.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.64 -0.662 . . . . 0.0 109.56 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.623 ' HB2' HD12 ' B' ' 67' ' ' LEU . 36.1 t80 -140.83 143.26 34.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.49 -0.756 . . . . 0.0 109.778 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.36 28.61 0.48 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.527 -0.733 . . . . 0.0 111.264 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.406 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 80.44 3.15 89.96 Favored Glycine 0 N--CA 1.494 2.535 0 C-N-CA 120.208 -0.996 . . . . 0.0 110.67 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -111.09 138.87 46.98 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.988 -1.301 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -78.13 133.77 37.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.226 -0.921 . . . . 0.0 109.305 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.799 HD12 ' HB3' ' B' ' 43' ' ' LEU . 35.7 mt -83.8 137.77 33.56 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.325 -0.859 . . . . 0.0 110.492 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -93.62 129.19 39.99 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.456 -0.778 . . . . 0.0 110.465 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.45 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.28 -27.07 2.28 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.43 -0.794 . . . . 0.0 111.201 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.86 -7.88 86.65 Favored Glycine 0 N--CA 1.493 2.45 0 C-N-CA 120.1 -1.048 . . . . 0.0 110.647 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 1.1 mmt180 -99.45 157.06 16.69 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.054 -1.263 . . . . 0.0 110.445 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 53.5 p -102.29 164.25 11.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.706 HD12 ' O ' ' B' ' 18' ' ' GLU . 81.5 mt -53.52 -45.94 69.93 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 110.678 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 28.7 t -56.73 -36.64 69.95 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.387 -0.82 . . . . 0.0 111.103 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -59.67 -28.13 67.01 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.255 -0.903 . . . . 0.0 110.414 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.509 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.3 m-85 -101.04 25.99 7.49 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.868 . . . . 0.0 110.098 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.9 m120 50.63 28.82 3.71 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.514 -0.741 . . . . 0.0 110.687 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' B' ' 56' ' ' LEU . 88.2 mt -81.44 111.21 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.352 -0.843 . . . . 0.0 109.945 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -105.69 172.38 6.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.455 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 14.4 pttp -46.65 154.18 0.33 Allowed 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.527 -0.733 . . . . 0.0 111.09 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.0 mm-40 62.88 16.54 9.22 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.793 -0.567 . . . . 0.0 110.727 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.47 143.7 49.95 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.104 -0.998 . . . . 0.0 109.866 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 91.7 m -107.65 110.52 22.4 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.229 -0.92 . . . . 0.0 110.147 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.707 HD22 ' N ' ' B' ' 67' ' ' LEU . 2.8 mm? -102.49 156.42 17.62 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.425 -0.797 . . . . 0.0 110.007 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -108.72 138.58 44.82 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.294 -0.879 . . . . 0.0 109.577 179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.486 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 1.2 tp -107.18 133.81 51.21 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.116 -0.99 . . . . 0.0 111.03 -179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.657 HG13 ' HB3' ' A' ' 92' ' ' GLN . 94.7 t -125.11 158.69 32.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.49 -0.756 . . . . 0.0 109.786 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 35.7 mt -94.26 128.0 40.47 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.366 -0.834 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.421 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 29.0 ttt-85 -99.4 106.93 19.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.305 -0.872 . . . . 0.0 110.168 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mt -112.62 123.07 49.48 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.337 -0.852 . . . . 0.0 110.175 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 15.7 ptt180 -61.42 125.12 22.65 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.355 -0.841 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 135.69 151.14 6.11 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.039 -1.423 . . . . 0.0 109.58 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 70.2 t60 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.246 0.546 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.1 mtp -119.51 -176.56 3.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.334 -0.854 . . . . 0.0 110.251 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.7 mt -110.43 23.39 14.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.503 -0.748 . . . . 0.0 109.483 179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.01 88.58 0.79 Allowed Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.2 pp -94.58 21.52 7.19 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.438 -1.037 . . . . 0.0 110.484 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -169.93 178.04 43.02 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.672 -1.371 . . . . 0.0 109.672 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.35 37.27 3.08 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.407 -1.055 . . . . 0.0 110.232 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 68.1 m -109.13 -26.5 10.1 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.325 -0.86 . . . . 0.0 110.289 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -31.48 70.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.267 -0.896 . . . . 0.0 110.134 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -88.1 -10.27 50.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.436 -0.79 . . . . 0.0 110.555 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -58.86 91.35 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.276 -0.89 . . . . 0.0 110.312 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 52.61 31.27 9.83 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.297 -0.877 . . . . 0.0 110.359 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.35 -20.53 44.79 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 -179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.51 HG23 ' N ' ' A' ' 15' ' ' ASP . 35.4 m -143.37 -41.1 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.138 -1.213 . . . . 0.0 110.677 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.51 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.0 OUTLIER -146.75 166.14 17.4 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.675 -179.637 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.79 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 34.8 Cg_endo -57.64 77.43 0.04 OUTLIER 'Trans proline' 0 C--N 1.312 -1.378 0 O-C-N 123.9 1.474 . . . . 0.0 111.45 -179.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.488 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.4 t 68.03 41.23 2.08 Favored 'General case' 0 N--CA 1.498 1.969 0 CA-C-O 121.463 0.649 . . . . 0.0 109.927 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.464 ' N ' ' OD1' ' A' ' 15' ' ' ASP . . . 41.32 31.81 0.18 Allowed 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.149 0.5 . . . . 0.0 110.786 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -161.73 115.26 1.24 Allowed Pre-proline 0 N--CA 1.489 1.504 0 O-C-N 121.317 -0.864 . . . . 0.0 110.26 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.61 -14.42 33.4 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 124.016 1.535 . . . . 0.0 109.952 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -72.81 -30.42 64.04 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.408 -0.807 . . . . 0.0 109.175 179.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.2 mt -85.63 -31.51 22.53 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.79 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -67.4 -42.66 82.93 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.516 -0.74 . . . . 0.0 109.324 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.77 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.8 OUTLIER -73.16 -32.49 64.89 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.579 -0.701 . . . . 0.0 109.579 179.444 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.06 -31.95 73.43 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.485 -0.76 . . . . 0.0 109.89 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' HA ' HD22 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -80.97 -22.94 39.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.448 -0.782 . . . . 0.0 110.068 179.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -84.76 -24.81 28.62 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.287 -0.883 . . . . 0.0 109.702 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 24' ' ' LEU . 58.5 t -82.26 -38.09 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.437 -0.79 . . . . 0.0 109.79 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -75.22 -35.27 61.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.427 -0.796 . . . . 0.0 109.979 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 ttt -69.11 -44.19 72.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.403 -0.81 . . . . 0.0 110.074 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.38 -38.7 91.96 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.366 -0.834 . . . . 0.0 110.2 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -69.25 -46.77 66.5 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.316 -0.865 . . . . 0.0 110.048 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.69 -29.94 69.63 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.471 -0.768 . . . . 0.0 110.123 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -78.8 -40.82 32.0 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.341 -0.85 . . . . 0.0 110.05 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -56.24 -31.71 63.81 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.379 -0.825 . . . . 0.0 110.189 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -80.32 -49.18 11.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.412 -0.805 . . . . 0.0 110.01 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.692 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 13.7 tm0? -69.17 -21.67 63.97 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.441 -0.787 . . . . 0.0 110.233 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -83.72 -58.1 2.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.386 -0.821 . . . . 0.0 109.611 179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.73 -33.61 35.4 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.57 -0.706 . . . . 0.0 109.348 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -83.39 -33.66 25.72 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.692 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.15 -50.75 66.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.515 -0.74 . . . . 0.0 109.54 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.587 ' HA ' ' HB3' ' A' ' 45' ' ' ALA . 6.0 ptt85 -68.39 -31.7 71.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.388 -0.82 . . . . 0.0 109.627 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -52.92 -41.99 64.98 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.42 -0.8 . . . . 0.0 109.184 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.22 -25.38 36.72 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.587 ' HB3' ' HA ' ' A' ' 42' ' ' ARG . . . -70.47 -31.38 68.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.605 -0.684 . . . . 0.0 109.706 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -81.64 -41.61 21.2 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.482 -0.761 . . . . 0.0 110.072 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.91 67.4 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.418 -0.801 . . . . 0.0 110.156 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.77 -32.79 16.81 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.411 -0.806 . . . . 0.0 110.239 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.416 ' O ' HG22 ' A' ' 54' ' ' ILE . . . -62.05 -40.52 96.02 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.406 -0.809 . . . . 0.0 110.194 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.89 -27.13 63.58 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.376 -0.827 . . . . 0.0 110.249 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -83.07 78.1 9.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.403 -0.811 . . . . 0.0 110.186 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.25 30.34 7.76 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.34 -0.85 . . . . 0.0 110.401 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -95.7 -59.23 1.08 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.416 HG22 ' O ' ' A' ' 49' ' ' ALA . 14.9 tt -115.95 -18.37 7.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.371 -1.076 . . . . 0.0 110.435 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.83 164.62 17.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.218 -0.927 . . . . 0.0 110.182 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 m -67.92 157.91 33.9 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.346 -0.846 . . . . 0.0 110.161 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 7.0 t -143.13 174.83 10.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.296 -0.877 . . . . 0.0 110.329 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -157.35 -90.23 0.08 OUTLIER Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.1 m -151.77 104.36 3.02 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.369 -1.077 . . . . 0.0 110.202 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -126.04 73.59 1.37 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 110.191 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.69 -66.15 0.92 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.378 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.37 71.89 0.9 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.275 -0.89 . . . . 0.0 110.194 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -72.7 -39.76 66.74 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.33 -0.856 . . . . 0.0 110.332 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -76.0 -29.55 58.2 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.199 -0.938 . . . . 0.0 109.083 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.11 -40.55 96.25 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.715 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.9 tp -66.51 -31.53 72.32 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 108.52 -0.919 . . . . 0.0 108.52 178.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.82 -47.15 48.83 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.565 -0.709 . . . . 0.0 109.665 179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.01 -55.24 5.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.465 -0.772 . . . . 0.0 110.314 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -49.7 -38.18 32.06 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.274 -0.892 . . . . 0.0 110.788 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 20.6 m -67.88 -43.08 80.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.285 -0.884 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 4.0 tp -81.78 -17.19 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.139 -0.976 . . . . 0.0 110.197 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.26 -0.9 . . . . 0.0 109.639 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -79.76 -24.87 41.25 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.51 -0.744 . . . . 0.0 109.885 179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -81.84 -38.17 25.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.463 -0.773 . . . . 0.0 110.261 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -72.86 -52.03 16.4 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.363 -0.836 . . . . 0.0 110.251 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -60.22 116.73 4.44 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.29 -0.881 . . . . 0.0 110.389 -179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -172.28 72.88 0.1 Allowed Glycine 0 N--CA 1.491 2.334 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.77 88.17 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.351 -1.088 . . . . 0.0 110.23 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.35 43.39 0.68 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.434 -0.791 . . . . 0.0 110.158 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -105.8 40.0 2.65 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -172.43 147.44 1.74 Allowed Pre-proline 0 N--CA 1.488 1.445 0 O-C-N 121.421 -1.046 . . . . 0.0 109.0 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -71.97 62.6 3.23 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 O-C-N 123.591 1.311 . . . . 0.0 110.231 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -57.71 110.32 0.87 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.382 -0.824 . . . . 0.0 110.386 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mp -84.73 -41.58 16.08 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.309 -0.87 . . . . 0.0 110.275 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 72.2 m -60.02 -31.34 69.86 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.402 -0.811 . . . . 0.0 110.214 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.5 m -84.71 -29.64 25.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.392 -0.818 . . . . 0.0 110.148 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.414 ' HB3' ' HG3' ' A' ' 92' ' ' GLN . 4.4 mtt -79.56 118.5 21.47 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.395 -0.815 . . . . 0.0 110.063 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 58.8 p -79.52 -162.19 0.39 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.335 -0.853 . . . . 0.0 110.546 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.495 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.4 pt-20 -67.89 -32.45 72.95 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.424 -0.798 . . . . 0.0 109.215 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.507 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 13.7 mt-10 -82.87 -40.03 20.79 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 179.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.41 ' HB3' ' CA ' ' A' ' 87' ' ' MET . 6.8 tp10 -64.47 -44.64 90.42 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.671 ' HB3' HG13 ' B' ' 70' ' ' VAL . 72.2 mt-30 -67.28 -33.52 75.48 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 177.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.507 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.2 OUTLIER -60.59 -38.88 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.37 -33.54 71.31 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.763 ' CD2' HD23 ' B' ' 8' ' ' LEU . 25.3 t80 -67.68 -42.06 82.69 Favored 'General case' 0 N--CA 1.486 1.375 0 CA-C-O 121.582 0.705 . . . . 0.0 109.236 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.752 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -70.44 -39.32 74.43 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.594 -0.691 . . . . 0.0 109.882 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.514 ' HA ' ' HG ' ' A' ' 100' ' ' SER . 43.7 mtt -78.41 -16.0 58.07 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.415 -0.803 . . . . 0.0 109.963 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -41.45 25.93 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.378 -0.826 . . . . 0.0 110.469 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 86.4 mtp -85.06 -23.29 28.62 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.311 -0.868 . . . . 0.0 110.593 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.514 ' HG ' ' HA ' ' A' ' 97' ' ' MET . 85.4 p -83.83 -25.17 30.56 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.32 -0.863 . . . . 0.0 110.269 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.764 HD13 ' HA3' ' B' ' 47' ' ' GLY . 13.5 tp -90.04 11.52 20.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 110.356 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.33 30.0 1.14 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.207 -0.933 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -96.61 -94.36 1.84 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -132.47 79.67 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.357 -1.084 . . . . 0.0 110.31 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -89.85 82.74 6.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.35 -0.844 . . . . 0.0 110.071 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -120.57 -65.66 1.13 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.353 -0.842 . . . . 0.0 110.206 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.76 148.62 12.93 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -103.45 62.68 0.78 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -1.082 . . . . 0.0 110.2 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -164.52 44.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.311 -0.868 . . . . 0.0 110.174 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -111.23 -50.31 2.95 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.352 -0.843 . . . . 0.0 110.265 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 10.9 p -162.29 56.19 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.146 -179.992 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.48 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 38.7 ttp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.308 0.575 . . . . 0.0 110.298 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.85 139.24 53.87 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.454 -0.779 . . . . 0.0 109.53 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 30.8 pt -137.58 157.16 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.23 -0.919 . . . . 0.0 110.532 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -111.99 144.02 42.02 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.731 -0.606 . . . . 0.0 110.553 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.79 119.61 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.413 -0.804 . . . . 0.0 109.552 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.5 mttt -100.07 130.41 46.22 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.427 -0.796 . . . . 0.0 110.298 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.413 HG22 ' CD2' ' B' ' 69' ' ' LEU . 76.4 p -95.59 174.81 6.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.394 -0.816 . . . . 0.0 110.017 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.763 HD23 ' CD2' ' A' ' 95' ' ' TYR . 8.9 mt -61.63 -13.06 19.02 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.368 -0.832 . . . . 0.0 110.994 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 71.8 p -95.97 16.35 18.07 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.055 -1.028 . . . . 0.0 110.709 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.55 9.73 65.54 Favored Glycine 0 N--CA 1.494 2.5 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 12.9 tttt -84.96 129.96 34.71 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.067 -1.255 . . . . 0.0 109.965 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 8.1 m -113.09 128.35 56.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.197 -0.939 . . . . 0.0 110.306 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 48.5 mt -109.28 140.44 28.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.484 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 15.2 m -102.33 121.66 42.73 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.465 -0.772 . . . . 0.0 109.311 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.427 HD11 HG12 ' B' ' 30' ' ' ILE . 13.0 mt -123.6 155.11 38.29 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.095 -1.003 . . . . 0.0 111.109 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -106.44 113.31 26.75 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.501 -0.749 . . . . 0.0 109.42 179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.586 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.2 m -140.24 -179.78 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.315 -0.866 . . . . 0.0 110.859 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.534 ' O ' HD12 ' B' ' 56' ' ' LEU . 7.4 mt-10 -113.19 164.84 14.57 Favored Pre-proline 0 N--CA 1.489 1.496 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 178.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -72.8 -26.51 15.77 Favored 'Trans proline' 0 C--N 1.307 -1.616 0 O-C-N 123.525 1.276 . . . . 0.0 110.215 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.7 m -84.46 -3.17 58.21 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.246 -0.909 . . . . 0.0 110.541 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -71.25 145.22 49.72 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.199 -0.938 . . . . 0.0 110.562 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 72.6 p -83.42 156.37 22.97 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.531 -0.731 . . . . 0.0 110.493 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 43.7 mm -59.63 -32.53 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.351 -0.843 . . . . 0.0 109.391 179.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -62.17 -36.71 82.7 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.468 -0.77 . . . . 0.0 109.257 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -70.35 -32.46 70.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.546 -0.721 . . . . 0.0 109.2 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 58.5 t -69.96 -39.96 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.456 -0.777 . . . . 0.0 109.097 179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mttt -63.0 -41.48 99.6 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.492 -0.755 . . . . 0.0 109.03 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.54 -34.85 76.25 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.583 -0.698 . . . . 0.0 109.372 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.586 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.9 mttm -67.9 -39.09 83.68 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.507 -0.746 . . . . 0.0 109.589 179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.427 HG12 HD11 ' B' ' 15' ' ' LEU . 9.7 mt -67.5 -38.81 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 C-N-CA 119.6 -0.84 . . . . 0.0 109.221 179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.66 -52.95 62.95 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.446 -0.784 . . . . 0.0 109.817 179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.01 -26.15 62.03 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.376 -0.827 . . . . 0.0 110.641 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.5 mmtp -84.17 -39.53 19.29 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.189 -0.945 . . . . 0.0 111.054 -179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -107.76 -53.65 2.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.155 -0.966 . . . . 0.0 110.337 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.24 15.63 2.48 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.176 -1.17 . . . . 0.0 110.176 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 53.6 mt -91.26 143.69 28.7 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.021 -1.282 . . . . 0.0 109.881 179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 39.7 Cg_endo -68.44 136.38 36.54 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.653 1.343 . . . . 0.0 110.503 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -61.0 -28.52 86.4 Favored 'Trans proline' 0 C--N 1.313 -1.333 0 O-C-N 123.735 1.387 . . . . 0.0 111.204 -179.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -68.79 -20.91 64.35 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.179 -0.95 . . . . 0.0 110.019 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.49 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 2.8 mt-30 -101.36 0.58 37.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.363 -0.836 . . . . 0.0 110.457 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -94.15 139.61 30.78 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.243 -0.911 . . . . 0.0 110.473 -179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' B' ' 69' ' ' LEU . 0.0 OUTLIER -130.2 127.48 39.74 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.53 -0.731 . . . . 0.0 109.74 179.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.791 ' C ' HD12 ' B' ' 44' ' ' ILE . 24.1 mt -104.24 123.84 48.06 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.411 -0.805 . . . . 0.0 110.435 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.791 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.22 132.12 71.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.502 -0.749 . . . . 0.0 109.766 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.546 ' HB2' HD23 ' B' ' 67' ' ' LEU . 76.8 t80 -141.2 152.46 44.64 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.44 -0.788 . . . . 0.0 109.952 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.14 27.71 0.34 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.472 -0.768 . . . . 0.0 111.43 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.764 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 80.09 -3.58 70.59 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.2 -1.0 . . . . 0.0 110.732 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.92 142.01 43.57 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.965 -1.314 . . . . 0.0 110.511 -179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -78.33 137.16 37.91 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.278 -0.889 . . . . 0.0 109.469 179.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.69 HD22 ' CG ' ' B' ' 59' ' ' TYR . 21.9 mt -83.83 139.65 32.53 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.246 -0.908 . . . . 0.0 110.455 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -93.75 129.97 39.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.491 -0.755 . . . . 0.0 110.477 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.435 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 m-20 -48.12 -26.85 2.04 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.461 -0.774 . . . . 0.0 111.129 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.71 -8.97 85.26 Favored Glycine 0 N--CA 1.493 2.449 0 C-N-CA 120.172 -1.013 . . . . 0.0 110.676 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.485 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.0 OUTLIER -99.3 158.13 15.92 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.988 -1.301 . . . . 0.0 110.518 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 50.9 p -102.24 165.62 11.04 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.377 -0.827 . . . . 0.0 110.418 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.584 ' HA ' HD12 ' B' ' 61' ' ' ILE . 87.1 mt -53.72 -45.59 70.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.299 -0.876 . . . . 0.0 110.621 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 5.0 p -57.01 -36.44 70.42 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.399 -0.813 . . . . 0.0 111.227 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -59.63 -27.94 66.78 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.0 110.468 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.69 ' CG ' HD22 ' B' ' 50' ' ' LEU . 48.4 m-85 -101.21 26.25 7.32 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.363 -0.836 . . . . 0.0 110.13 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 50.54 29.61 4.16 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.483 -0.761 . . . . 0.0 110.523 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.584 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.0 mt -81.24 110.33 16.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.414 -0.804 . . . . 0.0 109.828 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -105.57 171.06 7.53 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.425 -0.797 . . . . 0.0 110.273 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.415 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.6 OUTLIER -46.57 152.69 0.44 Allowed 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.628 -0.67 . . . . 0.0 110.996 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 33.8 mt-10 63.1 16.73 9.59 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.698 -0.626 . . . . 0.0 110.57 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.49 143.66 49.92 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.241 -0.912 . . . . 0.0 110.072 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 86.6 m -107.54 109.11 20.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.299 -0.876 . . . . 0.0 109.985 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.546 HD23 ' HB2' ' B' ' 45' ' ' PHE . 1.2 mt -102.69 160.03 14.95 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.36 -0.838 . . . . 0.0 110.003 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -108.48 137.64 46.09 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.229 -0.92 . . . . 0.0 109.878 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 6.4 tp -107.32 131.49 54.17 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.295 -0.878 . . . . 0.0 110.739 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.671 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.0 t -124.92 160.67 29.86 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.489 -0.757 . . . . 0.0 109.826 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 81.7 mt -94.15 111.64 23.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.285 -0.885 . . . . 0.0 110.317 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.45 67.04 5.09 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.86 158.64 32.12 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.407 -0.808 . . . . 0.0 110.216 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.14 141.68 32.88 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.343 -0.848 . . . . 0.0 110.171 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 65.53 147.6 0.06 OUTLIER Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.421 0 CA-C-O 118.018 -1.434 . . . . 0.0 109.525 -179.999 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.242 0.544 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.1 mmm -118.5 165.98 13.25 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.306 -0.871 . . . . 0.0 110.257 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.22 23.38 14.13 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.352 -0.842 . . . . 0.0 109.613 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.8 -63.42 2.72 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -149.53 22.18 0.92 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.364 -1.08 . . . . 0.0 110.258 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.567 ' O ' ' HB3' ' A' ' 7' ' ' ALA . . . -129.45 -103.02 1.05 Allowed Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.567 ' HB3' ' O ' ' A' ' 6' ' ' GLY . . . 65.22 -68.21 0.12 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.591 -0.946 . . . . 0.0 110.495 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 6' ' ' GLY . 0.4 OUTLIER -93.53 21.44 6.27 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 110.379 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -101.37 17.8 21.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.364 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -134.87 56.25 1.86 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.251 -0.906 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 15' ' ' ASP . 3.6 tt0 -97.4 126.08 42.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.381 -0.824 . . . . 0.0 109.973 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.525 ' CG ' HD23 ' A' ' 22' ' ' LEU . 77.5 m-85 53.67 53.21 11.8 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.357 -0.839 . . . . 0.0 109.95 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.495 ' C ' HG13 ' A' ' 14' ' ' VAL . . . 96.89 -50.21 1.53 Allowed Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.559 HG23 ' N ' ' A' ' 15' ' ' ASP . 26.9 m -151.64 -44.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.379 -1.071 . . . . 0.0 110.342 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.559 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.4 OUTLIER 175.85 165.33 0.42 Allowed Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.33 -0.856 . . . . 0.0 109.622 179.817 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.76 -23.65 22.35 Favored 'Trans proline' 0 C--N 1.31 -1.492 0 O-C-N 123.571 1.301 . . . . 0.0 110.687 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.26 0.49 14.03 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.187 -0.945 . . . . 0.0 110.969 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.62 5.94 49.71 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.997 -1.064 . . . . 0.0 110.419 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -169.35 118.3 0.57 Allowed Pre-proline 0 N--CA 1.489 1.505 0 O-C-N 121.126 -0.984 . . . . 0.0 110.118 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.84 -14.43 32.68 Favored 'Trans proline' 0 C--N 1.306 -1.665 0 O-C-N 124.038 1.546 . . . . 0.0 110.042 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 2.3 tt0 -75.18 -30.72 60.77 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.533 -0.73 . . . . 0.0 109.421 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD23 ' CG ' ' A' ' 12' ' ' PHE . 2.1 mp -86.86 -28.25 22.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.585 -0.697 . . . . 0.0 109.477 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.37 -41.58 60.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.465 -0.772 . . . . 0.0 109.562 179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 28' ' ' VAL . 1.5 tt -77.29 -32.34 55.4 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.5 -0.75 . . . . 0.0 109.723 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.18 -40.8 98.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.554 -0.716 . . . . 0.0 109.802 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 26' ' ' LEU . 1.8 mt -76.96 -22.03 53.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.428 -0.795 . . . . 0.0 109.978 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 41.9 ttt180 -78.85 -28.66 44.29 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.361 -0.837 . . . . 0.0 109.112 179.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.733 HG23 ' O ' ' A' ' 24' ' ' LEU . 96.1 t -76.63 -37.9 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 120.038 -0.665 . . . . 0.0 109.494 179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.5 m -65.24 -43.67 90.62 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.504 -0.748 . . . . 0.0 109.725 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.5 mmm -62.05 -40.12 94.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.464 -0.772 . . . . 0.0 109.874 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.98 -38.89 76.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.458 -0.776 . . . . 0.0 109.911 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.94 -41.21 95.71 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.364 -0.835 . . . . 0.0 109.887 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -62.17 -31.48 71.99 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.308 -0.87 . . . . 0.0 109.954 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -41.8 73.92 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.426 -0.796 . . . . 0.0 110.06 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -59.0 -41.49 87.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.433 -0.792 . . . . 0.0 110.186 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -48.32 50.43 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.373 -0.829 . . . . 0.0 109.935 179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.535 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.1 OUTLIER -63.16 -26.15 68.68 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.33 -0.856 . . . . 0.0 110.191 179.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -77.66 -54.92 5.81 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.424 -0.798 . . . . 0.0 109.672 179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -52.77 -33.77 50.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.296 -0.878 . . . . 0.0 109.015 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.74 -35.24 22.59 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.665 -0.647 . . . . 0.0 109.418 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.9 -57.18 5.35 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.33 -0.856 . . . . 0.0 109.826 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -57.51 -43.39 84.2 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.479 -0.763 . . . . 0.0 110.437 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 19.4 ttt-85 -55.04 -37.55 66.83 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.229 -0.919 . . . . 0.0 110.13 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.78 -32.93 70.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.396 -0.815 . . . . 0.0 109.781 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.6 -31.18 52.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.473 -0.767 . . . . 0.0 110.046 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.88 -46.74 64.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.445 -0.785 . . . . 0.0 110.043 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.24 98.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.37 -0.831 . . . . 0.0 110.066 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -73.26 -34.45 65.83 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.397 -0.814 . . . . 0.0 110.072 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -62.25 -35.53 79.23 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.44 -0.787 . . . . 0.0 110.045 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.4 -25.74 66.15 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.34 -0.85 . . . . 0.0 110.238 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -76.52 68.13 2.79 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.313 -0.867 . . . . 0.0 110.146 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.29 33.52 15.76 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.312 -0.867 . . . . 0.0 110.32 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -112.84 -36.0 1.6 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 4.2 tp -59.78 -32.54 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.315 -1.109 . . . . 0.0 110.175 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.86 118.06 22.04 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.399 -0.813 . . . . 0.0 110.133 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 56' ' ' THR . 8.2 t -144.6 132.05 20.88 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.415 -0.803 . . . . 0.0 110.227 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 8.1 t -155.37 33.46 0.37 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.345 -0.847 . . . . 0.0 110.178 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -164.3 30.35 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 16.9 m -100.59 67.37 1.29 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.388 -1.066 . . . . 0.0 110.119 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.87 75.84 7.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.0 110.228 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -66.9 -28.1 68.04 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.019 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.52 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 53.6 m -132.09 88.23 2.53 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.375 -0.828 . . . . 0.0 110.099 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -58.75 -32.17 69.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.253 -0.905 . . . . 0.0 110.313 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -75.77 -30.57 59.17 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.269 -0.895 . . . . 0.0 109.187 179.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.52 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -61.25 -43.2 99.27 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.391 -0.924 . . . . 0.0 108.885 179.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 66' ' ' LEU . 0.4 OUTLIER -63.43 -32.92 74.49 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.566 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.462 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.3 tt -70.67 -55.13 9.42 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.566 -0.709 . . . . 0.0 109.686 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.434 ' HA ' HG23 ' A' ' 71' ' ' ILE . 0.1 OUTLIER -66.71 -52.04 49.13 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.378 -0.826 . . . . 0.0 110.288 179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 8.5 ttt -50.5 -28.13 7.88 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.229 -0.92 . . . . 0.0 110.717 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.0 m -76.31 -47.82 22.27 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.204 -0.935 . . . . 0.0 110.496 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.959 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -69.47 -32.24 52.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.818 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 179.068 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.959 ' N ' HD13 ' A' ' 71' ' ' ILE . 35.5 t -57.96 -41.19 82.35 Favored 'General case' 0 C--N 1.298 -1.668 0 CA-C-O 121.243 0.544 . . . . 0.0 110.07 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -41.11 74.3 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.514 -0.741 . . . . 0.0 109.976 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -82.44 -14.23 55.45 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.298 -0.877 . . . . 0.0 110.551 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 71' ' ' ILE . 12.4 tt0 -95.61 -30.75 13.62 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.255 -0.903 . . . . 0.0 110.178 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 72' ' ' SER . 26.6 t80 -59.19 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.318 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -166.08 -59.23 0.03 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -122.11 115.81 23.12 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.402 -1.058 . . . . 0.0 110.006 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -121.98 27.78 7.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.0 110.237 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -95.96 18.8 56.77 Favored Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -174.79 152.87 1.63 Allowed Pre-proline 0 N--CA 1.488 1.435 0 O-C-N 121.269 -1.136 . . . . 0.0 108.916 179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -76.72 37.21 0.56 Allowed 'Trans proline' 0 C--N 1.304 -1.812 0 O-C-N 123.587 1.309 . . . . 0.0 110.845 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.555 ' N ' HD12 ' A' ' 81' ' ' LEU . 0.4 OUTLIER 51.3 70.96 0.48 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.048 -1.032 . . . . 0.0 110.66 -179.973 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 70.2 mt -75.01 -35.95 61.95 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.257 -0.902 . . . . 0.0 110.108 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.4 t -74.69 -3.39 31.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.405 -0.809 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.6 t -106.79 -9.89 16.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.064 -1.022 . . . . 0.0 110.085 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.437 ' HB2' ' CB ' ' A' ' 91' ' ' GLU . 15.2 ptp -106.61 141.28 38.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.344 -0.848 . . . . 0.0 109.691 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 92' ' ' GLN . 63.0 p -86.08 -173.61 4.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.582 -0.699 . . . . 0.0 111.117 -178.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.582 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 4.9 pt-20 -62.02 -30.82 71.22 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.652 -0.655 . . . . 0.0 109.486 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 7.5 mt-10 -77.95 -42.41 33.04 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 87' ' ' MET . 5.4 mm-40 -63.0 -43.92 97.45 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 4.7 mm-40 -67.27 -36.0 80.68 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 177.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.582 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -60.65 -41.05 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.391 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 98' ' ' GLN . . . -53.85 -35.2 61.26 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.811 ' CD2' HD13 ' B' ' 8' ' ' LEU . 20.2 t80 -64.48 -38.18 90.11 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.709 ' HB1' HG21 ' B' ' 44' ' ' ILE . . . -68.78 -40.13 79.83 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.682 -0.636 . . . . 0.0 109.616 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 53.0 mtt -78.62 -18.58 54.3 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.51 -0.744 . . . . 0.0 109.941 179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 94' ' ' ALA . 0.0 OUTLIER -81.1 -29.84 34.79 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.223 -0.923 . . . . 0.0 110.354 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 11.3 mmm -100.31 -14.94 18.2 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.314 -0.867 . . . . 0.0 110.614 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 65.3 p -98.74 -29.05 13.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 10.3 tp -99.84 27.62 5.32 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.281 -0.887 . . . . 0.0 110.233 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -132.03 26.69 4.58 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.406 -0.809 . . . . 0.0 110.287 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.97 47.93 0.87 Allowed Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -81.81 68.07 8.03 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.4 -1.059 . . . . 0.0 110.194 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -162.27 78.19 0.5 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.324 -0.86 . . . . 0.0 110.208 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . 0.499 ' CD1' ' N ' ' A' ' 106' ' ' PHE . 23.7 p90 -142.6 54.02 1.41 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.333 -0.854 . . . . 0.0 110.223 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.49 36.73 2.39 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.6 74.31 1.87 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.311 -1.111 . . . . 0.0 110.359 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -99.13 39.55 1.28 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.288 -0.883 . . . . 0.0 110.035 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.29 49.13 0.84 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 33.0 t -95.1 -35.97 11.69 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.356 -0.84 . . . . 0.0 110.14 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.235 179.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.518 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 41.9 ttp . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.334 0.588 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -128.74 139.1 52.37 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.342 -0.849 . . . . 0.0 109.887 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.577 HD12 HD22 ' B' ' 67' ' ' LEU . 34.9 pt -137.77 162.82 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.277 -0.889 . . . . 0.0 110.555 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -111.88 147.24 36.22 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.576 -0.703 . . . . 0.0 110.215 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' B' ' 12' ' ' THR . 70.8 t -128.67 127.84 67.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.263 -0.898 . . . . 0.0 109.688 179.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 0.4 OUTLIER -100.05 136.46 39.92 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.344 -0.848 . . . . 0.0 110.402 -179.519 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.3 p -95.84 172.18 8.18 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.496 -0.752 . . . . 0.0 110.449 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.811 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.05 -15.67 35.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.482 -0.761 . . . . 0.0 111.05 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 73.0 p -95.76 -17.77 20.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.174 -0.954 . . . . 0.0 110.79 -179.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 110.67 13.61 14.07 Favored Glycine 0 N--CA 1.492 2.419 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.5 OUTLIER -84.6 137.2 33.43 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.163 -1.198 . . . . 0.0 109.706 179.73 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 3.3 m -113.11 124.15 51.9 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.261 -0.899 . . . . 0.0 110.368 -179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.1 136.35 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.462 -0.774 . . . . 0.0 110.139 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 11.6 m -101.89 119.99 39.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.35 -0.844 . . . . 0.0 109.301 179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.532 HD11 HG12 ' B' ' 30' ' ' ILE . 42.0 mt -123.35 159.03 29.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.231 -0.918 . . . . 0.0 110.868 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -106.35 116.42 31.9 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.45 -0.781 . . . . 0.0 109.454 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.598 HG12 ' CD ' ' B' ' 29' ' ' LYS . 33.7 m -140.16 177.9 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.677 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.544 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.0 mt-10 -113.54 162.94 19.93 Favored Pre-proline 0 C--N 1.302 -1.464 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -71.77 -27.22 18.32 Favored 'Trans proline' 0 C--N 1.307 -1.624 0 O-C-N 123.465 1.245 . . . . 0.0 110.295 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.66 -3.38 58.49 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.149 -0.969 . . . . 0.0 110.579 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -71.23 143.74 50.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 77.4 p -83.32 158.5 22.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.546 -0.721 . . . . 0.0 110.461 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' B' ' 52' ' ' ASP . 37.5 mm -59.68 -30.66 45.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.357 -0.839 . . . . 0.0 109.444 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -38.25 90.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.416 -0.803 . . . . 0.0 109.259 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.18 -31.42 68.88 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.535 -0.728 . . . . 0.0 109.164 179.255 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 66.0 t -70.21 -40.25 77.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 C-N-CA 119.843 -0.743 . . . . 0.0 109.097 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.42 ' CE ' HG22 ' B' ' 23' ' ' ILE . 33.1 mttt -62.88 -43.38 98.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.448 -0.783 . . . . 0.0 109.22 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.39 -33.3 73.44 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.477 -0.764 . . . . 0.0 109.429 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.598 ' CD ' HG12 ' B' ' 17' ' ' VAL . 38.5 mttp -68.36 -40.95 81.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.484 -0.76 . . . . 0.0 109.651 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.532 HG12 HD11 ' B' ' 15' ' ' LEU . 17.0 mt -67.08 -38.28 80.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.294 -0.879 . . . . 0.0 109.167 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -60.44 -49.14 78.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.426 -0.797 . . . . 0.0 109.336 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -58.15 -27.64 63.97 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.426 -0.796 . . . . 0.0 110.257 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.76 -41.37 17.69 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.33 -0.856 . . . . 0.0 110.573 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -107.99 -59.25 1.87 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.314 -0.867 . . . . 0.0 110.249 -179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.45 22.17 1.1 Allowed Glycine 0 N--CA 1.493 2.483 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.489 HG23 ' HD2' ' B' ' 37' ' ' PRO . 59.6 mt -91.5 144.07 29.06 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.09 -1.241 . . . . 0.0 109.796 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.489 ' HD2' HG23 ' B' ' 36' ' ' ILE . 40.9 Cg_endo -68.08 130.91 22.48 Favored 'Trans proline' 0 C--N 1.309 -1.533 0 O-C-N 123.653 1.343 . . . . 0.0 110.192 179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.49 -24.65 78.62 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.715 1.376 . . . . 0.0 110.813 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -68.99 -25.23 64.41 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.268 -0.895 . . . . 0.0 109.731 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.426 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.4 mt-30 -101.32 1.13 38.33 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.447 -0.783 . . . . 0.0 110.487 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -94.19 138.64 31.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.106 -0.996 . . . . 0.0 110.533 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.487 ' C ' HD22 ' B' ' 43' ' ' LEU . 0.1 OUTLIER -130.14 131.62 45.75 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.413 -0.805 . . . . 0.0 109.823 179.668 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.487 HD22 ' C ' ' B' ' 42' ' ' ARG . 4.6 mm? -104.48 126.32 51.46 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.4 -0.813 . . . . 0.0 110.532 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.709 HG21 ' HB1' ' A' ' 96' ' ' ALA . 0.8 OUTLIER -121.67 142.57 37.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.604 -0.685 . . . . 0.0 109.846 179.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -140.97 137.69 33.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.475 -0.765 . . . . 0.0 109.783 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.5 27.88 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.443 -0.785 . . . . 0.0 111.317 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.93 6.65 84.88 Favored Glycine 0 N--CA 1.495 2.569 0 C-N-CA 120.267 -0.968 . . . . 0.0 110.787 179.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -111.03 132.8 53.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.059 -1.26 . . . . 0.0 110.469 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -78.02 128.46 33.9 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.136 -0.977 . . . . 0.0 109.884 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.787 HD22 ' CG ' ' B' ' 59' ' ' TYR . 15.0 mt -84.27 138.31 33.0 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.397 -0.814 . . . . 0.0 110.314 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.96 135.62 35.11 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.233 -0.917 . . . . 0.0 110.508 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.481 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 5.0 m-20 -48.44 -27.24 2.52 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.453 -0.779 . . . . 0.0 111.085 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.97 -7.96 86.46 Favored Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.498 -1.041 . . . . 0.0 110.498 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 32.5 mmt-85 -99.35 155.27 17.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 120.983 -1.304 . . . . 0.0 110.386 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 70.1 p -102.09 163.05 12.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.403 -0.81 . . . . 0.0 110.425 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.62 ' HA ' HD12 ' B' ' 61' ' ' ILE . 84.4 mt -53.69 -44.45 69.75 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.367 -0.833 . . . . 0.0 110.986 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.0 t -56.63 -35.32 68.19 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.33 -0.856 . . . . 0.0 111.211 -179.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -59.36 -27.65 66.14 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.203 -0.935 . . . . 0.0 110.418 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.787 ' CG ' HD22 ' B' ' 50' ' ' LEU . 68.3 m-85 -101.36 25.6 8.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.337 -0.852 . . . . 0.0 110.327 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 32.63 7.2 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.946 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' B' ' 56' ' ' LEU . 90.8 mt -81.61 112.35 19.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.198 -0.939 . . . . 0.0 109.991 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -105.93 169.23 8.61 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.382 -0.824 . . . . 0.0 110.412 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 11.8 ptpt -46.68 151.46 0.58 Allowed 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.504 -0.747 . . . . 0.0 111.346 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 3.2 mt-10 62.33 16.92 8.94 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.726 -0.609 . . . . 0.0 110.528 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.78 153.61 41.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.238 -0.914 . . . . 0.0 110.05 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 22.1 m -107.4 111.81 24.32 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.356 -0.84 . . . . 0.0 109.833 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.577 HD22 HD12 ' B' ' 3' ' ' ILE . 2.7 mp -102.14 152.87 20.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.48 -0.763 . . . . 0.0 110.061 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -108.62 134.14 51.77 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.906 . . . . 0.0 109.498 179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 31.8 tp -106.8 134.14 50.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.179 -0.951 . . . . 0.0 110.494 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.607 HG13 ' HB3' ' A' ' 92' ' ' GLN . 36.6 t -124.63 152.85 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.471 -0.768 . . . . 0.0 110.043 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 7.8 mt -94.08 122.14 36.29 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.445 -0.784 . . . . 0.0 110.294 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -104.67 111.6 24.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.317 -0.865 . . . . 0.0 110.111 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 mt -93.36 175.46 6.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.371 -0.831 . . . . 0.0 110.275 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -108.21 36.63 2.73 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.217 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.63 149.37 19.86 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 CA-C-O 118.055 -1.414 . . . . 0.0 109.58 179.994 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.199 0.523 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.1 mtm -78.97 176.1 9.95 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.415 -0.803 . . . . 0.0 110.225 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.11 26.23 10.91 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.5 -0.75 . . . . 0.0 109.269 179.398 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -100.35 -110.94 3.27 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 85.5 mt 51.77 48.3 23.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.398 -1.06 . . . . 0.0 110.466 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -141.33 -153.56 5.98 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -96.46 49.52 1.11 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.331 -1.099 . . . . 0.0 110.245 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.0 m -116.73 -22.92 8.37 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.435 -0.791 . . . . 0.0 110.544 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.66 -35.41 74.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -0.903 . . . . 0.0 110.31 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.488 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 13.5 p90 -148.05 59.49 1.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.301 -0.875 . . . . 0.0 110.37 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.3 75.32 0.24 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.456 -0.777 . . . . 0.0 110.247 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 51.9 62.63 2.6 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.361 -0.837 . . . . 0.0 110.59 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.98 28.17 0.73 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 34.6 m -116.71 -25.64 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -1.112 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 0.4 OUTLIER -75.88 -179.82 1.24 Allowed Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.38 -0.825 . . . . 0.0 110.102 -179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.836 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.9 Cg_endo -60.86 78.37 0.07 OUTLIER 'Trans proline' 0 C--N 1.314 -1.278 0 O-C-N 123.69 1.363 . . . . 0.0 110.867 -178.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.2 m 68.95 46.27 0.86 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 42.45 30.39 0.21 Allowed 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.993 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -165.2 115.17 0.86 Allowed Pre-proline 0 N--CA 1.489 1.506 0 O-C-N 121.253 -0.905 . . . . 0.0 110.592 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -71.3 -14.96 31.55 Favored 'Trans proline' 0 C--N 1.307 -1.631 0 O-C-N 124.09 1.574 . . . . 0.0 109.707 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -73.65 -30.8 63.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.403 -0.811 . . . . 0.0 109.067 179.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.2 -32.6 33.41 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.836 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -64.67 -40.56 95.62 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.902 -0.719 . . . . 0.0 109.357 179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.512 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -77.7 -29.85 51.58 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.527 -0.733 . . . . 0.0 109.683 179.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -72.54 -33.07 66.58 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.432 -0.793 . . . . 0.0 109.902 179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' A' ' 26' ' ' LEU . 44.7 tp -79.93 -21.75 43.5 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.352 -0.842 . . . . 0.0 110.17 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mtt85 -79.98 -27.87 39.6 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.326 -0.859 . . . . 0.0 109.247 179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 24' ' ' LEU . 90.4 t -83.32 -29.46 7.91 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.523 -0.735 . . . . 0.0 109.805 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.407 ' HA ' ' HG2' ' A' ' 32' ' ' GLU . 4.0 t -75.3 -31.76 60.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.461 -0.774 . . . . 0.0 109.988 179.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.2 mtt -79.67 -29.7 40.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.386 -0.821 . . . . 0.0 109.479 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -82.93 -33.2 26.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.586 -0.696 . . . . 0.0 110.057 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG2' ' HA ' ' A' ' 29' ' ' SER . 9.6 pt-20 -72.51 -33.96 67.29 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.251 -0.906 . . . . 0.0 109.85 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -75.25 -33.94 61.34 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.444 -0.785 . . . . 0.0 109.989 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -48.36 75.77 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.328 -0.857 . . . . 0.0 109.796 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -35.75 77.88 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.423 -0.798 . . . . 0.0 109.862 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.96 -53.02 12.31 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.427 -0.796 . . . . 0.0 110.0 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.689 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 5.1 mm100 -61.47 -25.96 67.59 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.432 -0.793 . . . . 0.0 110.053 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -83.74 -57.22 3.31 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.432 -0.793 . . . . 0.0 109.505 179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.72 -31.48 37.97 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.538 -0.726 . . . . 0.0 109.267 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.32 -33.66 20.53 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.689 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.16 -47.71 78.83 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.397 -0.815 . . . . 0.0 109.447 179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -69.03 -32.68 72.36 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.497 -0.752 . . . . 0.0 109.644 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.72 -40.71 66.31 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.4 -0.812 . . . . 0.0 109.118 179.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.65 41.35 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 178.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -62.8 -25.92 68.48 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.529 -0.732 . . . . 0.0 109.841 179.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -90.94 -45.84 8.51 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.107 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -68.73 -30.55 69.2 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.352 -0.843 . . . . 0.0 110.156 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 8.8 t -82.97 -37.75 23.63 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.299 -0.875 . . . . 0.0 110.149 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -62.14 -28.4 69.62 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.851 . . . . 0.0 110.186 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -85.19 -16.08 41.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.389 -0.82 . . . . 0.0 110.436 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -91.19 -57.11 2.9 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.266 -0.896 . . . . 0.0 110.181 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.58 25.93 4.24 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.384 -0.822 . . . . 0.0 110.163 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -108.52 -45.12 1.08 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.537 HG23 ' O ' ' A' ' 54' ' ' ILE . 1.3 tp -113.23 66.27 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.29 -1.124 . . . . 0.0 110.237 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -119.1 -4.32 10.57 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.585 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.535 HG23 ' O ' ' A' ' 56' ' ' THR . 7.8 t -103.73 66.65 0.86 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.176 -0.952 . . . . 0.0 110.347 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.4 m -73.79 -56.24 5.22 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.322 -0.861 . . . . 0.0 110.176 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -160.55 52.81 0.35 Allowed Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.2 m -87.38 54.01 3.0 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.352 -1.087 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -111.29 63.61 0.61 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.846 . . . . 0.0 110.242 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -78.68 -37.3 42.11 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.304 -0.873 . . . . 0.0 110.191 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 11.9 p -96.7 69.45 2.49 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.297 -0.877 . . . . 0.0 110.251 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.01 -69.77 0.42 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.333 -0.854 . . . . 0.0 110.107 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -73.38 -28.15 61.86 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.283 -0.886 . . . . 0.0 108.996 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.76 -44.62 96.54 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.598 -0.841 . . . . 0.0 108.896 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.16 -29.39 70.51 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 178.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.5 tt -74.09 -49.05 25.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.454 -0.779 . . . . 0.0 109.836 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -53.19 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.374 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -36.5 50.54 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.303 -0.873 . . . . 0.0 110.663 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 15.6 m -69.58 -44.35 70.98 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.266 -0.896 . . . . 0.0 110.233 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.416 ' HA ' HD12 ' A' ' 71' ' ' ILE . 6.2 tp -82.78 -14.31 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.132 -0.98 . . . . 0.0 110.241 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 16.9 t -74.25 -42.03 60.31 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.331 -0.856 . . . . 0.0 109.638 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -80.31 -28.39 38.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.585 -0.697 . . . . 0.0 109.754 179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -80.09 -40.86 26.71 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.401 -0.812 . . . . 0.0 110.016 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.83 -36.13 75.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.39 -0.819 . . . . 0.0 109.997 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -73.13 -32.72 65.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.403 -0.811 . . . . 0.0 110.137 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.53 -32.32 80.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.4 ttm180 -96.65 115.28 27.17 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.371 -1.076 . . . . 0.0 110.058 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.9 m -122.5 3.32 9.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.295 -0.878 . . . . 0.0 110.609 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -63.47 -17.01 59.27 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -169.84 149.54 3.53 Favored Pre-proline 0 N--CA 1.487 1.411 0 O-C-N 121.217 -1.167 . . . . 0.0 108.85 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -76.09 40.38 0.74 Allowed 'Trans proline' 0 C--N 1.305 -1.746 0 O-C-N 123.516 1.271 . . . . 0.0 110.918 -179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.5 75.82 0.17 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.05 -1.031 . . . . 0.0 110.552 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 12.2 mt -72.69 -33.07 66.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.281 -0.887 . . . . 0.0 110.243 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 52.1 m -62.63 -23.34 67.02 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.312 -0.868 . . . . 0.0 110.276 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 30.8 t -80.5 -29.13 37.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.262 -0.899 . . . . 0.0 110.033 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.409 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 33.7 mtm -87.67 119.42 27.97 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.361 -0.837 . . . . 0.0 109.826 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 69.7 p -79.62 -164.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.424 -0.797 . . . . 0.0 110.51 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.542 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 12.7 pt-20 -66.29 -31.89 72.97 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.469 -0.769 . . . . 0.0 109.363 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.488 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 12.2 mt-10 -85.17 -40.39 16.77 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.73 -44.84 92.36 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.607 ' HB3' HG13 ' B' ' 70' ' ' VAL . 47.7 mt-30 -67.89 -34.19 76.17 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.542 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -60.17 -39.4 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 178.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.65 71.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.649 ' CD2' HD13 ' B' ' 8' ' ' LEU . 18.2 t80 -63.48 -55.28 25.33 Favored 'General case' 0 N--CA 1.488 1.432 0 CA-C-O 121.363 0.602 . . . . 0.0 109.856 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -67.93 -32.51 73.0 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.385 -0.822 . . . . 0.0 110.351 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.4 ' O ' HD12 ' A' ' 101' ' ' LEU . 41.6 mtp -76.86 -21.55 54.82 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.27 -0.894 . . . . 0.0 109.69 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -83.49 -22.49 32.51 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.466 -0.771 . . . . 0.0 110.424 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 24.9 mmt -89.72 -26.94 20.39 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.341 -0.85 . . . . 0.0 110.412 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -88.29 -25.0 23.03 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.32 -0.862 . . . . 0.0 110.418 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.4 HD12 ' O ' ' A' ' 97' ' ' MET . 30.3 mt -82.6 3.23 29.62 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.341 -0.85 . . . . 0.0 110.639 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -141.43 50.95 1.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.13 -0.981 . . . . 0.0 110.13 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -134.14 -55.95 0.07 OUTLIER Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -84.07 74.12 10.3 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -1.116 . . . . 0.0 110.196 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -153.09 28.48 0.51 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.39 -0.819 . . . . 0.0 110.184 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.06 75.11 1.63 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.362 -0.836 . . . . 0.0 110.13 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -103.36 36.59 4.23 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 7.8 mm100 -105.78 54.54 0.69 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.394 -1.062 . . . . 0.0 110.178 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -108.77 88.76 2.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.362 -0.836 . . . . 0.0 110.083 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -95.87 35.46 1.4 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.371 -0.83 . . . . 0.0 110.366 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.0 t -71.6 174.96 6.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.356 -0.84 . . . . 0.0 110.129 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.219 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.445 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 49.0 ttp . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.152 0.501 . . . . 0.0 110.345 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -84.78 139.29 32.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.347 -0.846 . . . . 0.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.494 HD13 HG21 ' B' ' 17' ' ' VAL . 27.7 pt -137.55 159.91 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.376 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.7 ' CE1' HG23 ' B' ' 14' ' ' THR . 48.3 m-85 -111.56 142.55 43.72 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.654 -0.654 . . . . 0.0 110.451 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 92.3 t -128.25 124.51 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.291 -0.881 . . . . 0.0 109.853 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 25.0 mttt -99.97 129.78 46.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.336 -0.852 . . . . 0.0 110.465 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 59.1 p -96.07 179.61 5.01 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.343 -0.848 . . . . 0.0 110.486 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.649 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.38 -14.83 30.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.462 -0.774 . . . . 0.0 111.177 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 77.2 p -95.54 17.58 14.46 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.096 -1.003 . . . . 0.0 110.81 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 66.54 9.47 50.8 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 110.375 -1.09 . . . . 0.0 110.375 179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 27.5 tttp -85.22 138.52 32.3 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.995 -1.297 . . . . 0.0 109.807 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.1 m -113.23 129.13 56.61 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.349 -0.845 . . . . 0.0 110.229 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.409 HD13 HG21 ' B' ' 13' ' ' ILE . 6.0 mt -109.18 140.87 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.7 HG23 ' CE1' ' B' ' 4' ' ' PHE . 4.7 m -101.87 118.41 36.87 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.329 -0.857 . . . . 0.0 109.34 179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.2 mt -123.43 161.5 24.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.209 -0.932 . . . . 0.0 110.947 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -106.41 116.72 32.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.412 -0.805 . . . . 0.0 109.587 179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.494 HG21 HD13 ' B' ' 3' ' ' ILE . 33.6 m -140.0 173.51 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.271 -0.893 . . . . 0.0 110.585 -179.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.668 ' O ' HD12 ' B' ' 56' ' ' LEU . 2.9 mp0 -113.15 164.03 16.61 Favored Pre-proline 0 C--N 1.302 -1.467 0 O-C-N 121.63 -0.669 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -71.9 -28.73 16.12 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.581 1.306 . . . . 0.0 110.361 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 p -84.45 -1.84 56.28 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.163 -0.96 . . . . 0.0 110.361 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 41.5 p -83.3 155.68 23.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.486 -0.759 . . . . 0.0 110.388 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.632 HG23 HD12 ' B' ' 43' ' ' LEU . 41.7 mm -59.41 -34.59 54.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.222 -0.924 . . . . 0.0 109.546 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -61.27 -35.52 77.53 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.367 -0.833 . . . . 0.0 109.276 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -70.74 -32.83 70.13 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.572 -0.705 . . . . 0.0 109.338 179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.97 -40.55 78.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.433 -0.792 . . . . 0.0 109.17 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -62.94 -41.58 99.54 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.403 -0.811 . . . . 0.0 109.094 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.52 -34.37 75.4 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.53 -0.731 . . . . 0.0 109.389 178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 mttp -68.28 -39.6 82.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.522 -0.736 . . . . 0.0 109.576 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 mt -67.2 -37.8 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.042 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -60.87 -50.78 72.04 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.483 -0.761 . . . . 0.0 109.457 178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -58.07 -27.59 63.78 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.533 -0.729 . . . . 0.0 110.548 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 22.7 mmtt -83.91 -39.73 19.45 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.297 -0.877 . . . . 0.0 110.578 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -108.38 -59.22 1.89 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.361 -0.837 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.86 18.91 1.33 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.498 HG23 ' HD2' ' B' ' 37' ' ' PRO . 61.4 mt -91.45 143.6 28.4 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.024 -1.28 . . . . 0.0 109.971 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.498 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.7 Cg_endo -68.72 132.31 24.76 Favored 'Trans proline' 0 C--N 1.31 -1.491 0 O-C-N 123.632 1.333 . . . . 0.0 110.326 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -60.65 -26.37 82.78 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.628 1.33 . . . . 0.0 110.938 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -68.99 -23.37 64.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.427 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 5.3 mt-30 -101.18 -3.69 28.63 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.399 -0.813 . . . . 0.0 110.497 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -94.17 139.99 30.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.218 -0.926 . . . . 0.0 110.422 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.92 135.32 48.2 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.463 -0.773 . . . . 0.0 109.519 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.632 HD12 HG23 ' B' ' 23' ' ' ILE . 15.1 mt -104.6 128.05 52.5 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.207 -0.933 . . . . 0.0 110.436 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 68' ' ' HIS . 14.9 mm -120.88 135.91 59.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.67 -0.644 . . . . 0.0 109.758 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -140.85 136.24 32.17 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.25 -0.906 . . . . 0.0 109.903 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.56 28.46 0.52 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.473 -0.767 . . . . 0.0 111.236 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.4 88.52 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 110.495 -1.042 . . . . 0.0 110.495 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? -110.92 129.11 55.98 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.044 -1.268 . . . . 0.0 110.308 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.81 132.84 38.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.17 -0.956 . . . . 0.0 109.37 179.445 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.646 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.0 mt -83.85 139.19 32.81 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.242 -0.911 . . . . 0.0 110.544 -179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -93.56 129.87 39.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.429 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 3.2 m-20 -48.22 -25.55 1.57 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.503 -0.748 . . . . 0.0 111.24 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.72 -10.18 83.56 Favored Glycine 0 N--CA 1.494 2.511 0 C-N-CA 120.112 -1.042 . . . . 0.0 110.608 -179.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . 0.46 ' HB3' ' CE2' ' B' ' 59' ' ' TYR . 0.3 OUTLIER -99.4 158.41 15.74 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.017 -1.284 . . . . 0.0 110.489 -179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 19.3 p -102.58 166.68 10.38 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.431 -0.793 . . . . 0.0 110.341 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.668 HD12 ' O ' ' B' ' 18' ' ' GLU . 93.5 mt -53.76 -48.19 69.95 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.348 -0.845 . . . . 0.0 110.744 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 2.4 t -56.73 -36.93 70.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.411 -0.806 . . . . 0.0 111.053 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -59.45 -27.67 66.3 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.201 -0.937 . . . . 0.0 110.3 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.646 ' CG ' HD22 ' B' ' 50' ' ' LEU . 37.2 m-85 -101.18 27.68 5.95 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.354 -0.841 . . . . 0.0 109.988 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 50.75 28.48 3.64 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.45 -0.781 . . . . 0.0 110.813 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.663 HD12 ' HA ' ' B' ' 56' ' ' LEU . 87.1 mt -81.42 109.35 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.376 -0.827 . . . . 0.0 109.766 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -105.85 173.52 6.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.368 -0.832 . . . . 0.0 110.565 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.3 OUTLIER -46.83 152.87 0.45 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.58 -0.7 . . . . 0.0 111.202 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 12.7 mt-10 62.76 15.99 8.62 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.798 -0.564 . . . . 0.0 110.637 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.59 141.87 50.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.177 -0.952 . . . . 0.0 110.054 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 24.6 m -107.17 111.23 23.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.303 -0.873 . . . . 0.0 109.864 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.429 HD21 HD13 ' B' ' 61' ' ' ILE . 1.1 mt -102.15 155.44 18.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.343 -0.848 . . . . 0.0 110.093 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.523 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 48.1 m80 -108.55 141.32 40.63 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.397 -0.814 . . . . 0.0 109.821 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.652 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.73 134.69 50.34 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.12 -0.988 . . . . 0.0 110.641 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.652 ' N ' HD23 ' B' ' 69' ' ' LEU . 36.8 t -125.03 153.56 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.454 -0.779 . . . . 0.0 109.834 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 9.4 mt -94.23 115.1 27.31 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.338 -0.852 . . . . 0.0 110.086 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.95 115.51 27.53 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.47 165.29 12.62 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.41 -0.806 . . . . 0.0 110.168 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -113.4 137.85 50.93 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.343 -0.848 . . . . 0.0 110.212 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -87.5 -90.83 1.03 Allowed Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.42 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.945 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.162 0.506 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.657 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -155.16 -55.33 0.09 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.346 -0.846 . . . . 0.0 110.24 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.657 HD12 ' O ' ' A' ' 2' ' ' MET . 0.6 OUTLIER 76.83 35.97 0.36 Allowed 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.013 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.95 -105.46 0.04 OUTLIER Glycine 0 N--CA 1.481 1.639 0 N-CA-C 109.794 -1.323 . . . . 0.0 109.794 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.43 77.01 1.25 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.35 -1.088 . . . . 0.0 110.065 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -88.9 -103.57 1.02 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.28 -39.76 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.424 -1.045 . . . . 0.0 110.312 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 35.3 t -54.1 -28.83 41.82 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.271 -0.893 . . . . 0.0 110.285 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.94 -35.76 80.7 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.385 -0.822 . . . . 0.0 109.95 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.849 ' CD2' HG21 ' A' ' 14' ' ' VAL . 1.3 m-85 -112.81 94.57 4.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.345 -0.847 . . . . 0.0 110.03 179.741 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.615 ' O ' ' HB3' ' A' ' 12' ' ' PHE . 30.6 tt0 -140.45 127.62 20.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.428 -0.795 . . . . 0.0 109.694 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.615 ' HB3' ' O ' ' A' ' 11' ' ' GLU . 45.1 t80 66.55 -55.68 0.41 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.806 -0.559 . . . . 0.0 110.879 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.422 ' N ' ' O ' ' A' ' 11' ' ' GLU . . . -51.85 -26.04 17.26 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 109.997 -1.241 . . . . 0.0 109.997 -179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.849 HG21 ' CD2' ' A' ' 10' ' ' PHE . 84.2 t -94.78 -66.17 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.193 -1.181 . . . . 0.0 110.097 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.43 168.47 9.08 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.405 -0.809 . . . . 0.0 110.069 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.52 -19.24 28.63 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 O-C-N 123.713 1.375 . . . . 0.0 110.718 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -69.62 -10.31 57.71 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 0.0 110.621 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.33 -15.43 63.68 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.194 -0.941 . . . . 0.0 110.534 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.49 120.47 0.6 Allowed Pre-proline 0 N--CA 1.488 1.452 0 O-C-N 121.24 -0.912 . . . . 0.0 109.852 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.91 -14.71 35.96 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.996 1.524 . . . . 0.0 110.309 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -77.76 -31.86 52.27 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.421 -0.799 . . . . 0.0 109.507 179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.6 mp -86.31 -25.35 25.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.542 -0.724 . . . . 0.0 109.403 179.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.29 -38.38 42.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.538 -0.726 . . . . 0.0 109.573 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' O ' HG23 ' A' ' 28' ' ' VAL . 13.3 mt -80.12 -31.21 39.13 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.393 -0.817 . . . . 0.0 109.693 179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.31 -37.94 81.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.485 -0.759 . . . . 0.0 109.797 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.421 HD12 ' HA ' ' A' ' 26' ' ' LEU . 43.9 tp -79.28 -21.53 45.94 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.531 -0.731 . . . . 0.0 110.273 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.71 -28.83 36.53 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.291 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 24' ' ' LEU . 99.2 t -80.34 -27.95 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.607 -0.683 . . . . 0.0 109.753 179.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.0 m -75.57 -41.95 53.45 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.403 -0.811 . . . . 0.0 110.012 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.47 -43.36 81.18 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.396 -0.815 . . . . 0.0 110.041 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.09 -36.58 84.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.344 -0.848 . . . . 0.0 109.971 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -64.26 -40.65 96.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.326 -0.859 . . . . 0.0 110.038 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -63.05 -30.94 71.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.322 -0.861 . . . . 0.0 110.048 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -68.65 -43.69 75.71 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.335 -0.853 . . . . 0.0 110.122 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -61.94 -31.78 72.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.473 -0.767 . . . . 0.0 110.092 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 11.7 mtt-85 -81.5 -40.91 22.52 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.841 . . . . 0.0 109.997 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -77.57 -23.14 50.07 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.344 -0.847 . . . . 0.0 110.299 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -83.95 -61.49 1.81 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.394 -0.816 . . . . 0.0 109.549 179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -52.67 -29.81 28.45 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.362 -0.836 . . . . 0.0 109.24 179.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -84.06 -38.38 20.9 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.67 -0.644 . . . . 0.0 109.471 179.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.548 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.52 -54.9 11.91 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.357 -0.839 . . . . 0.0 109.965 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 mtt-85 -58.64 -36.85 74.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.418 -0.802 . . . . 0.0 110.236 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 1.5 mmt85 -58.67 -42.24 88.03 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.267 -0.895 . . . . 0.0 109.916 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.37 -29.29 53.23 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.415 -0.803 . . . . 0.0 109.852 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.15 -26.53 63.04 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.423 -0.798 . . . . 0.0 110.113 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -84.49 -32.11 24.15 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.373 -0.83 . . . . 0.0 110.172 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -78.9 -27.24 43.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 110.183 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.6 m -82.64 -34.19 27.6 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.329 -0.857 . . . . 0.0 110.161 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.02 -34.17 59.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.319 -0.863 . . . . 0.0 110.195 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.35 -18.73 59.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.377 -0.827 . . . . 0.0 110.25 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -107.95 -38.12 5.9 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.317 -0.864 . . . . 0.0 110.38 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -111.7 -18.4 12.77 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.418 -0.801 . . . . 0.0 110.46 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.81 -81.86 0.22 Allowed Glycine 0 N--CA 1.491 2.366 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.1 pt -93.85 68.33 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -1.125 . . . . 0.0 110.283 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -92.05 -32.12 15.3 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.426 -0.796 . . . . 0.0 110.159 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 17.1 p -87.03 120.03 27.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.322 -0.861 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.9 m -128.7 163.52 24.94 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.411 -0.806 . . . . 0.0 110.217 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -142.51 98.3 0.21 Allowed Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.413 -1.475 . . . . 0.0 109.413 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 24.0 m -83.09 72.53 10.11 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.357 -1.084 . . . . 0.0 110.285 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -112.79 94.56 4.97 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.41 -0.806 . . . . 0.0 110.073 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -115.54 -36.75 4.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.463 -0.773 . . . . 0.0 110.344 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.475 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 68.1 m -118.61 71.41 0.84 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.37 -0.831 . . . . 0.0 110.257 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -77.62 -60.36 2.4 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.293 -0.879 . . . . 0.0 110.265 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -74.54 -30.29 61.7 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.475 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -61.26 -44.15 97.71 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.512 -0.875 . . . . 0.0 108.873 179.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.36 -32.06 72.79 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 5.2 tt -71.89 -56.83 5.0 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.594 -0.692 . . . . 0.0 109.77 179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.94 -52.53 55.84 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.474 -0.766 . . . . 0.0 110.301 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.2 tpp -51.65 -28.53 14.79 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.247 -0.908 . . . . 0.0 110.673 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 14.6 m -74.41 -40.6 61.91 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.152 -0.967 . . . . 0.0 110.548 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.971 HD13 ' N ' ' A' ' 72' ' ' SER . 0.0 OUTLIER -78.62 -32.22 16.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 C-N-CA 119.236 -0.986 . . . . 0.0 108.355 179.024 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.971 ' N ' HD13 ' A' ' 71' ' ' ILE . 1.3 t -58.71 -36.13 73.76 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.01 -33.9 29.84 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.82 . . . . 0.0 110.091 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -86.62 -14.07 43.81 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.369 -0.832 . . . . 0.0 110.548 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.424 ' N ' ' O ' ' A' ' 71' ' ' ILE . 38.0 tt0 -90.59 -41.51 11.32 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.173 -0.955 . . . . 0.0 110.139 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -96.04 -25.13 16.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.448 -0.783 . . . . 0.0 110.246 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.01 -29.06 71.55 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.55 100.5 3.79 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.282 -1.128 . . . . 0.0 110.254 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.745 ' O ' HD12 ' A' ' 81' ' ' LEU . 91.7 m -92.87 -104.38 0.12 Allowed 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.503 -0.748 . . . . 0.0 109.873 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.505 ' N ' HG22 ' A' ' 79' ' ' THR . . . 51.16 39.71 42.74 Favored Glycine 0 N--CA 1.495 2.572 0 N-CA-C 109.889 -1.284 . . . . 0.0 109.889 179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.745 HD12 ' O ' ' A' ' 79' ' ' THR . 0.3 OUTLIER -157.99 140.41 10.43 Favored Pre-proline 0 C--N 1.305 -1.327 0 O-C-N 121.391 -1.064 . . . . 0.0 108.667 179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -74.51 40.02 0.59 Allowed 'Trans proline' 0 C--N 1.304 -1.795 0 O-C-N 123.44 1.232 . . . . 0.0 110.678 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 49.76 83.2 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.29 -0.881 . . . . 0.0 110.497 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.542 HD11 HD12 ' B' ' 8' ' ' LEU . 0.7 OUTLIER -82.78 -38.99 22.4 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.45 -0.781 . . . . 0.0 110.339 -179.741 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -68.11 -12.01 60.12 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.407 -0.808 . . . . 0.0 110.691 -179.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -100.3 -25.12 14.35 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.216 -0.928 . . . . 0.0 109.847 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.433 ' C ' HG23 ' A' ' 88' ' ' THR . 20.2 mtt -67.52 -162.32 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.46 -0.775 . . . . 0.0 109.822 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.433 HG23 ' C ' ' A' ' 87' ' ' MET . 77.4 p -148.55 -171.1 3.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.893 . . . . 0.0 110.278 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.566 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -65.78 -32.91 74.72 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.47 -0.769 . . . . 0.0 109.246 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.48 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 4.3 mt-10 -85.26 -42.13 14.93 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.361 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.99 -44.93 94.67 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.689 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.0 mt-30 -67.27 -33.62 75.68 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 177.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.566 ' HB ' ' O ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -61.82 -39.5 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.145 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.46 67.79 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.693 ' CD2' HD13 ' B' ' 8' ' ' LEU . 19.5 t80 -68.27 -37.95 81.24 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-O 121.418 0.628 . . . . 0.0 109.372 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.596 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -77.07 -32.99 57.15 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.648 -0.657 . . . . 0.0 109.965 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.444 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 9.4 mtt -83.07 -23.55 33.1 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.404 -0.81 . . . . 0.0 109.944 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -83.12 -35.88 25.26 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.38 -0.825 . . . . 0.0 110.34 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.1 -26.31 42.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.364 -0.835 . . . . 0.0 110.196 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.425 ' HB3' ' N ' ' B' ' 46' ' ' ALA . 62.4 m -80.97 -36.4 30.86 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.379 -0.826 . . . . 0.0 110.501 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.69 -14.7 59.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.308 -0.87 . . . . 0.0 110.495 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.11 35.77 1.69 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.237 -0.915 . . . . 0.0 110.236 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -135.16 86.3 0.25 Allowed Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -163.83 83.79 0.45 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.361 -1.082 . . . . 0.0 110.258 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -96.19 49.6 1.14 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.345 -0.847 . . . . 0.0 110.084 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -115.36 -43.5 3.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.456 -0.777 . . . . 0.0 110.135 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.53 77.15 0.39 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.623 -1.391 . . . . 0.0 109.623 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -131.52 86.63 2.37 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.326 -1.102 . . . . 0.0 110.14 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -167.28 84.5 0.23 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.402 -0.811 . . . . 0.0 110.251 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 54.32 31.78 15.04 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.363 -0.836 . . . . 0.0 110.476 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.9 m -112.63 99.67 8.12 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.311 -0.868 . . . . 0.0 110.172 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.2 -179.922 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.489 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 40.0 ttp . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.349 0.595 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -121.76 139.03 54.1 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.374 -0.829 . . . . 0.0 109.717 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.595 HD12 HD22 ' B' ' 67' ' ' LEU . 34.1 pt -137.52 162.11 33.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.192 -0.942 . . . . 0.0 110.41 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -111.77 147.61 35.3 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.558 -0.714 . . . . 0.0 110.468 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.4 t -128.7 124.35 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.288 -0.882 . . . . 0.0 109.893 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 5.0 mttt -99.96 136.16 40.29 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.42 -0.8 . . . . 0.0 110.179 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 70.1 p -95.98 173.48 7.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.365 -0.834 . . . . 0.0 110.625 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.693 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.3 mm? -61.65 -12.22 15.13 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.541 -0.724 . . . . 0.0 111.259 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 82.8 p -95.44 -21.78 18.11 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.066 -1.021 . . . . 0.0 110.837 -178.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.05 6.38 20.67 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.155 -1.178 . . . . 0.0 110.155 179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.36 137.72 33.27 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.115 -1.226 . . . . 0.0 109.956 179.874 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 27.9 m -113.34 129.37 56.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.514 -0.741 . . . . 0.0 110.171 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -109.98 146.41 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.775 0 O-C-N 121.263 -0.898 . . . . 0.0 110.297 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.769 ' C ' HD12 ' B' ' 15' ' ' LEU . 3.0 m -102.03 121.24 41.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.502 -0.748 . . . . 0.0 109.079 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.769 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.08 154.57 38.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.061 -1.024 . . . . 0.0 111.046 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.41 114.53 28.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.513 -0.742 . . . . 0.0 109.375 179.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.489 ' O ' ' HB3' ' B' ' 1' ' ' MET . 33.3 m -140.37 172.79 11.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.271 -0.893 . . . . 0.0 110.939 -179.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -113.44 165.06 14.16 Favored Pre-proline 0 N--CA 1.49 1.537 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -72.36 -27.68 15.9 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.514 1.271 . . . . 0.0 110.488 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -84.4 -2.82 57.78 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.037 -1.039 . . . . 0.0 110.359 179.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -71.26 142.01 50.55 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -0.97 . . . . 0.0 110.491 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 69.6 p -83.16 158.19 22.46 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.497 -0.752 . . . . 0.0 110.24 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.606 HG23 HD12 ' B' ' 43' ' ' LEU . 44.6 mm -59.91 -31.04 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.4 -0.813 . . . . 0.0 109.505 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -63.17 -37.66 88.11 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.437 -0.789 . . . . 0.0 109.02 179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -70.26 -31.57 69.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.635 -0.665 . . . . 0.0 109.227 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 62.0 t -70.27 -41.36 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.489 -0.757 . . . . 0.0 109.21 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 14.1 mttt -62.96 -43.23 99.37 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.412 -0.805 . . . . 0.0 109.249 179.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.28 -33.42 73.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.394 -0.816 . . . . 0.0 109.297 179.075 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.474 ' CD ' HG12 ' B' ' 17' ' ' VAL . 27.1 mttp -68.42 -37.3 80.18 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.555 -0.715 . . . . 0.0 109.322 179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 14.7 mt -67.45 -42.2 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.419 -0.801 . . . . 0.0 109.312 179.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.35 -49.16 78.68 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.404 -0.81 . . . . 0.0 109.611 179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.15 -26.35 62.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.461 -0.775 . . . . 0.0 110.193 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mmtm -83.48 -44.69 14.45 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.398 -0.814 . . . . 0.0 109.949 179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -108.48 -116.9 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.82 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . -162.85 23.38 0.19 Allowed Glycine 0 N--CA 1.493 2.448 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.452 HG23 ' HD2' ' B' ' 37' ' ' PRO . 78.9 mt -91.92 143.12 27.25 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.146 -1.208 . . . . 0.0 110.11 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.455 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 41.0 Cg_endo -69.07 135.62 32.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.663 1.349 . . . . 0.0 110.111 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -60.97 -27.63 85.08 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.718 1.378 . . . . 0.0 110.943 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -68.92 -24.66 64.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.262 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.455 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 14.4 mt-30 -101.35 6.5 42.72 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.241 -0.912 . . . . 0.0 110.735 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -94.35 137.83 33.03 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.106 -0.996 . . . . 0.0 110.559 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -130.02 130.3 44.79 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.459 -0.776 . . . . 0.0 109.805 179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.672 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.7 mt -104.76 125.36 50.76 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.401 -0.812 . . . . 0.0 110.623 -179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.672 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.49 139.18 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.642 -0.661 . . . . 0.0 109.621 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -140.84 133.59 28.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.474 -0.767 . . . . 0.0 110.138 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . 0.425 ' N ' ' HB3' ' A' ' 100' ' ' SER . . . 45.12 26.97 0.27 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.472 -0.767 . . . . 0.0 111.691 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.444 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 90.77 0.49 75.16 Favored Glycine 0 N--CA 1.494 2.555 0 C-N-CA 120.086 -1.054 . . . . 0.0 110.946 179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -111.08 126.26 54.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.0 -1.294 . . . . 0.0 110.471 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -77.71 135.82 38.1 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.249 -0.907 . . . . 0.0 109.407 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.808 HD22 ' CD2' ' B' ' 59' ' ' TYR . 31.9 mt -84.25 139.88 32.05 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.377 -0.827 . . . . 0.0 110.543 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -93.72 134.47 36.02 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.52 -0.737 . . . . 0.0 110.358 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.479 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 4.4 p30 -48.46 -30.41 5.1 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.469 -0.769 . . . . 0.0 111.339 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.06 -6.75 87.94 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 120.136 -1.031 . . . . 0.0 110.698 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -99.3 157.04 16.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.971 -1.311 . . . . 0.0 110.559 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 69.9 p -102.28 160.9 14.13 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.412 -0.805 . . . . 0.0 110.12 179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.432 ' HA ' HD12 ' B' ' 61' ' ' ILE . 73.2 mt -53.55 -43.7 68.65 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.308 -0.87 . . . . 0.0 110.935 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 11.4 t -56.62 -35.08 67.9 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.358 -0.839 . . . . 0.0 111.084 -179.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -59.72 -26.05 65.31 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.212 -0.93 . . . . 0.0 110.412 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.808 ' CD2' HD22 ' B' ' 50' ' ' LEU . 78.5 m-85 -100.74 22.8 11.41 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.247 -0.908 . . . . 0.0 110.278 179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 50.71 33.13 7.82 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.377 -0.827 . . . . 0.0 110.94 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.432 HD12 ' HA ' ' B' ' 56' ' ' LEU . 96.6 mt -81.29 115.14 23.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.323 -0.86 . . . . 0.0 109.786 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -105.53 166.58 10.34 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.463 -0.773 . . . . 0.0 110.5 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.59 153.5 0.37 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.561 -0.712 . . . . 0.0 111.234 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 38.1 mt-10 62.94 15.43 8.34 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.698 -0.626 . . . . 0.0 110.583 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -71.85 154.91 40.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.265 -0.897 . . . . 0.0 110.185 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 6.2 m -107.4 113.73 27.28 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.316 -0.865 . . . . 0.0 109.898 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.595 HD22 HD12 ' B' ' 3' ' ' ILE . 2.0 mp -102.33 149.11 24.67 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.656 -0.653 . . . . 0.0 109.985 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -108.36 130.82 55.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.24 -0.913 . . . . 0.0 109.328 179.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 26.0 tp -106.9 133.97 50.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.191 -0.943 . . . . 0.0 110.756 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.689 HG13 ' HB3' ' A' ' 92' ' ' GLN . 41.3 t -124.88 151.17 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.531 -0.73 . . . . 0.0 109.912 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -94.26 116.62 29.03 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.409 -0.807 . . . . 0.0 110.398 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 51.2 ttt180 -107.08 130.57 54.66 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.448 -0.782 . . . . 0.0 110.05 179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 10.9 mt -71.13 179.22 2.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.336 -0.852 . . . . 0.0 110.24 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.61 158.77 35.6 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.361 -0.837 . . . . 0.0 110.194 -179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.75 61.18 0.16 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.579 -179.961 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.261 0.553 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -157.31 -166.6 2.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.072 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -111.83 24.5 12.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.445 -0.784 . . . . 0.0 109.569 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.17 68.89 3.26 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.92 -64.91 0.34 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.335 -1.097 . . . . 0.0 110.158 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -152.78 172.3 31.85 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -132.34 28.36 4.37 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.342 -1.093 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.3 t -140.1 21.05 2.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.34 -0.85 . . . . 0.0 110.417 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.406 ' OD2' ' CE2' ' A' ' 10' ' ' PHE . 45.5 p-10 -91.42 -14.69 30.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.286 -0.884 . . . . 0.0 110.379 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.406 ' CE2' ' OD2' ' A' ' 9' ' ' ASP . 19.8 m-85 -127.68 56.78 1.55 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.223 -0.923 . . . . 0.0 110.071 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.54 57.53 4.1 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.278 -0.889 . . . . 0.0 110.398 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 6.7 m-85 51.28 40.55 26.5 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.347 -0.846 . . . . 0.0 110.531 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.436 ' C ' HG13 ' A' ' 14' ' ' VAL . . . -136.44 27.6 2.96 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.632 -1.387 . . . . 0.0 109.632 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.508 HG23 ' N ' ' A' ' 15' ' ' ASP . 35.8 m -148.68 -40.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -1.105 . . . . 0.0 110.469 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.53 ' O ' ' N ' ' A' ' 17' ' ' SER . 28.0 p30 -135.86 163.52 49.87 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.263 -0.898 . . . . 0.0 109.975 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.68 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 35.6 Cg_endo -57.99 73.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.836 1.44 . . . . 0.0 111.745 -178.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.53 ' N ' ' O ' ' A' ' 15' ' ' ASP . 1.7 m 63.26 34.17 13.55 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.51 0.671 . . . . 0.0 109.361 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' C ' ' O ' ' A' ' 17' ' ' SER . . . 37.21 35.29 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 121.221 0.534 . . . . 0.0 111.226 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -169.62 120.88 0.6 Allowed Pre-proline 0 N--CA 1.489 1.518 0 O-C-N 121.42 -0.8 . . . . 0.0 109.801 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -70.03 -15.36 36.06 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.04 1.548 . . . . 0.0 110.107 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -76.27 -27.8 56.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.455 -0.778 . . . . 0.0 109.442 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 mt -90.51 -27.37 19.24 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.58 -0.7 . . . . 0.0 109.537 179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -72.69 -41.32 65.45 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.437 -0.789 . . . . 0.0 109.653 179.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.715 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -78.49 -33.21 48.33 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.456 -0.777 . . . . 0.0 109.685 179.627 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.98 -35.47 80.67 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.456 -0.777 . . . . 0.0 109.935 179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -23.47 42.18 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.413 -0.804 . . . . 0.0 110.135 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 11.8 ttm105 -84.91 -30.88 24.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.336 -0.852 . . . . 0.0 109.546 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 24' ' ' LEU . 92.1 t -79.33 -37.65 19.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.498 0 O-C-N 121.463 -0.773 . . . . 0.0 109.835 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 67.6 m -70.54 -43.64 69.13 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.45 -0.781 . . . . 0.0 110.082 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 12.2 tpt -63.35 -34.13 77.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.349 -0.844 . . . . 0.0 109.956 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -69.47 -37.81 77.45 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.425 -0.797 . . . . 0.0 109.992 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -62.03 -47.65 83.78 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.369 -0.832 . . . . 0.0 110.098 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -61.44 -39.17 89.84 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.431 -0.793 . . . . 0.0 110.007 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -71.72 -30.8 66.04 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.33 -0.856 . . . . 0.0 110.04 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -61.88 -41.65 98.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.339 -0.851 . . . . 0.0 109.965 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.6 mtm180 -79.57 -40.81 28.6 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.493 -0.754 . . . . 0.0 110.045 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.674 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 2.9 mm100 -67.7 -23.77 65.32 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.388 -0.82 . . . . 0.0 110.149 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -83.84 -59.33 2.45 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.482 -0.761 . . . . 0.0 109.633 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -51.55 -31.91 26.13 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.505 -0.747 . . . . 0.0 109.232 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -84.23 -34.98 23.77 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.674 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -64.04 -50.71 67.36 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.481 -0.762 . . . . 0.0 109.566 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 5.2 ptt85 -70.7 -29.58 65.9 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.397 -0.815 . . . . 0.0 109.621 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.53 -38.07 66.13 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.849 . . . . 0.0 109.148 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.65 -29.03 40.8 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.99 -27.84 69.68 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.54 -0.725 . . . . 0.0 109.746 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -87.77 -40.14 14.33 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.457 -0.777 . . . . 0.0 110.047 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.05 -29.51 69.32 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.352 -0.843 . . . . 0.0 110.054 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 74.5 m -84.68 -32.43 23.59 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.446 -0.784 . . . . 0.0 110.279 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.75 -28.58 61.76 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.424 -0.798 . . . . 0.0 110.228 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -77.2 -10.28 59.31 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.398 -0.814 . . . . 0.0 110.514 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -100.96 -36.15 9.13 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.155 -0.966 . . . . 0.0 110.254 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.54 -32.43 11.11 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.296 -0.878 . . . . 0.0 110.206 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.24 -58.73 3.84 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.564 ' O ' HG22 ' A' ' 54' ' ' ILE . 39.9 mm -83.87 68.74 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.339 -1.095 . . . . 0.0 110.214 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -168.96 33.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.262 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 40.0 p -139.89 81.76 1.84 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.319 -0.863 . . . . 0.0 110.245 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 21.7 p -100.38 71.52 1.56 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.411 -0.805 . . . . 0.0 110.206 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -162.17 31.13 0.31 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.6 m -129.63 101.11 5.77 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -1.105 . . . . 0.0 110.136 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -82.33 73.48 9.37 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.365 -0.834 . . . . 0.0 110.147 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.0 -58.62 5.1 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.397 -0.815 . . . . 0.0 110.285 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.492 ' HB3' ' HB2' ' A' ' 65' ' ' ALA . 70.5 m -133.04 96.66 3.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.318 -0.864 . . . . 0.0 110.295 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -62.89 -33.57 75.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.292 -0.88 . . . . 0.0 110.105 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -75.91 -27.69 57.75 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.286 -0.884 . . . . 0.0 109.211 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 62' ' ' SER . . . -62.5 -43.53 98.59 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.547 -0.861 . . . . 0.0 108.858 179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 mp -65.55 -30.71 71.49 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.663 ' O ' HD13 ' A' ' 67' ' ' LEU . 2.2 tm? -73.12 -42.67 62.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.615 -0.678 . . . . 0.0 109.443 179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' SER . 3.6 mmmt -78.38 -57.19 3.91 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.473 -0.767 . . . . 0.0 110.474 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.2 tpt -50.37 -41.07 51.21 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.223 -0.923 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 38.8 m -67.09 -44.47 79.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.543 -179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 ' HA ' ' A' ' 71' ' ' ILE . 6.4 tp -84.67 -10.67 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.221 -0.924 . . . . 0.0 110.603 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 68' ' ' LYS . 1.5 m -76.91 -45.13 29.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.167 -0.958 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -29.41 29.41 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.405 -0.809 . . . . 0.0 110.039 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -76.1 -39.9 54.2 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.328 -0.858 . . . . 0.0 109.968 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.07 -57.44 4.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.448 -0.783 . . . . 0.0 109.931 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 50.98 76.39 0.16 Allowed 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.372 -0.83 . . . . 0.0 110.344 -179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.05 -79.35 0.09 OUTLIER Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.464 ' NH2' HD13 ' A' ' 81' ' ' LEU . 0.0 OUTLIER -73.7 107.99 6.27 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.292 -1.122 . . . . 0.0 110.267 -179.809 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.3 m -153.29 25.33 0.53 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.358 -0.839 . . . . 0.0 110.218 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.523 ' C ' HD12 ' A' ' 81' ' ' LEU . . . -97.41 21.93 43.5 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.711 -1.356 . . . . 0.0 109.711 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD12 ' C ' ' A' ' 80' ' ' GLY . 0.5 OUTLIER -159.98 144.68 11.02 Favored Pre-proline 0 N--CA 1.484 1.243 0 O-C-N 121.34 -1.094 . . . . 0.0 108.733 179.721 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -76.39 39.45 0.68 Allowed 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 123.495 1.26 . . . . 0.0 110.697 -179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 50.76 91.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.7 tp -60.93 -32.23 71.74 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 110.163 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 81.4 p -60.82 -23.75 65.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.359 -0.838 . . . . 0.0 110.298 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.6 t -80.99 -27.76 35.78 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.348 -0.845 . . . . 0.0 109.897 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 3.6 mtt -88.15 119.82 28.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.876 . . . . 0.0 109.935 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 67.6 p -78.38 -164.52 0.57 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.332 -0.855 . . . . 0.0 110.424 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.484 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 5.6 pt-20 -67.3 -31.26 71.44 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.442 -0.786 . . . . 0.0 109.259 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.516 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 11.9 mt-10 -85.42 -40.26 16.64 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -45.18 92.0 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 178.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.629 ' HB3' HG13 ' B' ' 70' ' ' VAL . 43.3 mt-30 -67.05 -33.86 76.43 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.752 HD11 ' CD ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -61.04 -39.81 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 178.242 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.52 -30.42 68.58 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 178.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD2' HD13 ' B' ' 8' ' ' LEU . 26.3 t80 -66.35 -39.36 89.13 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 121.404 0.621 . . . . 0.0 109.67 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.738 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -82.4 -32.63 29.04 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.592 -0.693 . . . . 0.0 110.292 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -26.3 46.39 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.261 -0.899 . . . . 0.0 109.5 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -80.15 -44.13 20.41 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.524 -0.735 . . . . 0.0 110.202 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 30.8 mtm -78.58 -10.24 59.66 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.441 -0.787 . . . . 0.0 110.566 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.2 t -97.78 -21.21 17.08 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.236 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.497 HD13 ' HA3' ' B' ' 47' ' ' GLY . 15.1 tp -91.51 16.45 10.34 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.266 -0.896 . . . . 0.0 110.401 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -95.88 -37.38 10.73 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.204 -0.935 . . . . 0.0 110.155 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -70.56 -34.33 67.55 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -99.57 88.57 3.88 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -1.097 . . . . 0.0 110.147 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -71.83 65.31 0.51 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -168.44 107.32 0.49 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.283 -0.886 . . . . 0.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -146.25 131.19 3.97 Favored Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.625 -1.39 . . . . 0.0 109.625 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -127.42 76.24 1.65 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.318 -1.107 . . . . 0.0 110.188 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -125.76 38.59 4.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.311 -0.868 . . . . 0.0 110.307 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 51.78 55.2 9.68 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.28 -0.888 . . . . 0.0 110.483 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 12.9 t -99.67 175.09 5.93 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.319 -0.863 . . . . 0.0 110.212 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.951 -1.023 . . . . 0.0 110.243 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.463 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 47.9 ttp . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.178 0.513 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 24.4 tt0 -89.58 138.67 31.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.387 -0.821 . . . . 0.0 109.8 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.41 HD12 HD22 ' B' ' 67' ' ' LEU . 13.3 pt -137.44 165.32 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.258 -0.901 . . . . 0.0 110.468 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -111.77 144.22 41.42 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.629 -0.67 . . . . 0.0 110.573 -179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' B' ' 12' ' ' THR . 93.9 t -128.58 121.52 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.351 -0.843 . . . . 0.0 109.812 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.589 ' HG2' HG23 ' B' ' 12' ' ' THR . 33.9 mtmt -99.66 129.14 45.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.331 -0.856 . . . . 0.0 110.062 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.492 HG22 HD23 ' B' ' 69' ' ' LEU . 73.3 p -95.47 179.31 5.2 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.311 -0.868 . . . . 0.0 110.584 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.37 -14.76 30.08 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.601 -0.687 . . . . 0.0 111.13 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 68.4 p -95.8 15.69 19.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.066 -1.021 . . . . 0.0 110.855 -179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.38 9.4 61.09 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 110.336 -1.106 . . . . 0.0 110.336 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.8 OUTLIER -84.8 133.84 34.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.094 -1.239 . . . . 0.0 109.73 179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.589 HG23 ' HG2' ' B' ' 6' ' ' LYS . 3.5 m -112.91 126.98 56.07 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.312 -0.867 . . . . 0.0 110.326 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 25.5 mt -109.31 139.03 33.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.479 -0.763 . . . . 0.0 110.342 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 3.1 m -102.02 117.39 34.71 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.447 -0.783 . . . . 0.0 109.182 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.481 HD11 HG12 ' B' ' 30' ' ' ILE . 56.1 mt -123.22 164.99 17.66 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.112 -0.993 . . . . 0.0 110.965 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -106.24 117.81 35.0 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.484 -0.76 . . . . 0.0 109.541 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.624 HG12 ' HD3' ' B' ' 29' ' ' LYS . 33.1 m -140.1 169.54 16.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.353 -0.842 . . . . 0.0 110.582 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -113.05 163.65 17.51 Favored Pre-proline 0 N--CA 1.488 1.474 0 O-C-N 121.486 -0.759 . . . . 0.0 109.328 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -71.61 -26.19 20.02 Favored 'Trans proline' 0 C--N 1.307 -1.649 0 O-C-N 123.509 1.268 . . . . 0.0 110.299 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -84.55 -5.86 59.33 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.267 -0.896 . . . . 0.0 110.329 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 91.6 m-20 -71.24 143.8 50.29 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.261 -0.9 . . . . 0.0 110.59 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 76.6 p -83.23 161.85 21.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.513 -0.742 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.696 HG23 HD12 ' B' ' 43' ' ' LEU . 46.2 mm -59.8 -39.68 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.368 -0.832 . . . . 0.0 109.591 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -59.84 -32.46 70.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.36 -0.837 . . . . 0.0 109.397 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.67 -35.98 73.1 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.496 -0.753 . . . . 0.0 109.36 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.83 -38.33 75.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 C-N-CA 119.742 -0.783 . . . . 0.0 109.109 179.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.414 ' HE2' HG22 ' B' ' 23' ' ' ILE . 19.4 mtmt -62.99 -42.8 99.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.416 -0.803 . . . . 0.0 108.993 178.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.47 -32.82 72.83 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.601 -0.687 . . . . 0.0 109.393 178.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.624 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.6 mttt -68.02 -39.86 83.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.533 -0.729 . . . . 0.0 109.318 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.481 HG12 HD11 ' B' ' 15' ' ' LEU . 13.3 mt -67.2 -36.63 77.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.298 -0.877 . . . . 0.0 108.9 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' B' ' 35' ' ' GLY . 0.4 OUTLIER -60.83 -51.74 68.02 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.45 -0.781 . . . . 0.0 109.512 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.98 -26.92 62.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.488 -0.758 . . . . 0.0 110.544 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmtm -83.73 -39.98 19.43 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.226 -0.922 . . . . 0.0 110.662 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -108.09 -56.45 2.24 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.219 -0.926 . . . . 0.0 110.428 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 131.1 14.53 1.8 Allowed Glycine 0 N--CA 1.493 2.469 0 N-CA-C 110.353 -1.099 . . . . 0.0 110.353 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.483 HG23 ' HD2' ' B' ' 37' ' ' PRO . 55.9 mt -91.49 143.01 27.48 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.005 -1.291 . . . . 0.0 109.913 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.503 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.1 Cg_endo -69.26 135.77 32.53 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.601 1.316 . . . . 0.0 110.677 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -60.89 -26.29 82.85 Favored 'Trans proline' 0 N--CA 1.49 1.284 0 O-C-N 123.797 1.42 . . . . 0.0 111.179 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -68.31 -22.93 64.68 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.24 -0.913 . . . . 0.0 109.87 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.503 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 1.7 mp0 -100.43 -2.81 32.34 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.464 -0.773 . . . . 0.0 110.478 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -94.17 143.08 26.69 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.21 -0.931 . . . . 0.0 110.496 -179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.752 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.5 OUTLIER -130.16 131.8 45.79 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.424 -0.797 . . . . 0.0 109.78 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.798 ' C ' HD12 ' B' ' 44' ' ' ILE . 19.9 mt -104.57 125.2 50.49 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.441 -0.787 . . . . 0.0 110.659 -179.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.798 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.8 mp -121.42 132.72 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.825 -0.547 . . . . 0.0 109.714 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.472 ' HB3' HD21 ' B' ' 50' ' ' LEU . 42.8 t80 -141.27 148.91 40.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.38 -0.825 . . . . 0.0 110.023 179.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.13 28.74 0.43 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.527 -0.733 . . . . 0.0 111.423 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.497 ' HA3' HD13 ' A' ' 101' ' ' LEU . . . 78.87 -0.09 79.42 Favored Glycine 0 N--CA 1.494 2.53 0 C-N-CA 120.243 -0.979 . . . . 0.0 110.736 179.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.95 138.54 47.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.046 -1.267 . . . . 0.0 110.126 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -78.23 134.87 37.51 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.31 -0.869 . . . . 0.0 109.563 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.649 HD22 ' CG ' ' B' ' 59' ' ' TYR . 23.2 mt -84.19 138.7 32.84 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 -179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -93.63 134.28 36.1 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.332 -0.855 . . . . 0.0 110.634 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.488 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 1.1 m-20 -48.44 -28.18 3.11 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.477 -0.765 . . . . 0.0 111.12 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.04 -7.59 86.89 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -99.46 155.93 17.29 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.044 -1.268 . . . . 0.0 110.55 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.519 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 81.5 p -102.45 160.8 14.24 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.369 -0.832 . . . . 0.0 110.043 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 89.6 mt -53.58 -42.13 67.29 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.243 -0.911 . . . . 0.0 110.671 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 58.9 p -57.06 -35.75 69.71 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.369 -0.832 . . . . 0.0 111.13 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.48 -25.91 64.82 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.19 -0.944 . . . . 0.0 110.43 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.649 ' CG ' HD22 ' B' ' 50' ' ' LEU . 88.4 m-85 -100.91 23.13 11.09 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.364 -0.835 . . . . 0.0 110.199 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m120 50.6 33.44 8.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.4 -0.813 . . . . 0.0 110.891 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . . . . . . . . . 79.9 mt -81.52 116.81 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.305 -0.872 . . . . 0.0 109.914 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.79 167.27 9.89 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.354 -0.841 . . . . 0.0 110.495 -179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 0.0 OUTLIER -46.72 152.66 0.46 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.69 . . . . 0.0 111.295 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 28.3 mt-10 62.79 15.76 8.45 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.789 -0.569 . . . . 0.0 110.766 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -71.49 155.35 40.69 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.179 -0.951 . . . . 0.0 110.172 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 10.4 m -107.46 112.01 24.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.476 -0.765 . . . . 0.0 109.757 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.446 HD23 HD22 ' B' ' 43' ' ' LEU . 4.3 mp -102.17 153.91 19.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.454 -0.779 . . . . 0.0 109.95 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -108.55 130.58 55.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.2 -0.938 . . . . 0.0 109.673 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.492 HD23 HG22 ' B' ' 7' ' ' THR . 49.1 tp -106.85 133.48 51.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.133 -0.979 . . . . 0.0 110.659 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.629 HG13 ' HB3' ' A' ' 92' ' ' GLN . 39.2 t -124.74 152.69 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.498 -0.751 . . . . 0.0 109.827 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -93.93 126.4 39.12 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.363 -0.835 . . . . 0.0 110.435 -179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.03 102.08 11.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.353 -0.842 . . . . 0.0 110.045 179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 57.14 171.33 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.302 -0.874 . . . . 0.0 110.187 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -119.73 170.83 8.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.385 -0.822 . . . . 0.0 110.329 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 158.98 79.47 0.03 OUTLIER Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.332 0 CA-C-O 117.987 -1.452 . . . . 0.0 109.547 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 33.0 m170 . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.22 0.534 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.57 ' O ' ' CB ' ' A' ' 3' ' ' LEU . 0.7 OUTLIER -155.53 -52.21 0.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.358 -0.839 . . . . 0.0 110.111 -179.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.57 ' CB ' ' O ' ' A' ' 2' ' ' MET . 3.8 tp 80.97 35.87 0.1 Allowed 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.15 -85.82 0.37 Allowed Glycine 0 N--CA 1.481 1.677 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 52.46 34.65 15.75 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.368 -1.077 . . . . 0.0 110.444 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -93.22 112.49 4.29 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.529 -1.429 . . . . 0.0 109.529 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -97.46 29.6 3.2 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.357 -1.084 . . . . 0.0 110.24 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -116.39 -30.35 5.93 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.344 -0.847 . . . . 0.0 110.287 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.08 -38.37 76.26 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.284 -0.885 . . . . 0.0 110.291 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -102.09 87.0 2.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.373 -0.829 . . . . 0.0 110.149 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -98.15 75.73 2.32 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 110.29 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 t80 -159.96 -44.34 0.05 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.34 -0.85 . . . . 0.0 110.175 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -113.07 30.37 7.42 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.354 -1.498 . . . . 0.0 109.354 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.487 HG23 ' N ' ' A' ' 15' ' ' ASP . 33.7 m -130.97 -39.39 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.445 -1.032 . . . . 0.0 110.295 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.487 ' N ' HG23 ' A' ' 14' ' ' VAL . 14.0 p-10 -125.08 142.93 42.66 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.414 -0.804 . . . . 0.0 110.241 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.39 -28.56 17.91 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.566 1.298 . . . . 0.0 110.377 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -61.1 -23.39 65.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 110.264 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.72 -21.64 55.59 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.187 -0.946 . . . . 0.0 110.418 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -169.53 120.31 0.6 Allowed Pre-proline 0 N--CA 1.49 1.532 0 O-C-N 121.33 -0.856 . . . . 0.0 109.803 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -69.35 -14.93 38.22 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.988 1.52 . . . . 0.0 110.213 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -76.06 -29.95 58.2 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.42 -0.8 . . . . 0.0 109.398 179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.39 -26.15 21.18 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.593 -0.692 . . . . 0.0 109.495 179.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.43 68.78 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.467 -0.771 . . . . 0.0 109.708 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.658 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.5 OUTLIER -84.31 -28.32 27.19 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.466 -0.771 . . . . 0.0 109.836 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.62 -36.84 65.52 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.398 -0.814 . . . . 0.0 109.946 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 56.0 tp -82.85 -21.25 34.43 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.369 -0.832 . . . . 0.0 110.225 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.7 ttt180 -79.76 -29.71 40.55 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.258 -0.901 . . . . 0.0 109.284 179.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.658 HG23 ' O ' ' A' ' 24' ' ' LEU . 74.6 t -82.86 -31.82 9.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 O-C-N 121.575 -0.703 . . . . 0.0 109.9 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 72.6 m -71.09 -45.37 63.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.533 -0.73 . . . . 0.0 110.142 179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.64 -37.08 81.93 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.527 -0.733 . . . . 0.0 110.052 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.81 -36.1 77.82 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.347 -0.846 . . . . 0.0 110.14 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.9 -49.6 74.18 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.271 -0.893 . . . . 0.0 109.948 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.29 -35.77 82.02 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.311 -0.868 . . . . 0.0 110.094 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.2 ttp180 -69.66 -38.91 77.29 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.344 -0.848 . . . . 0.0 110.113 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.51 -45.61 93.49 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.37 -0.831 . . . . 0.0 110.07 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -68.14 -40.52 82.39 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.312 -0.868 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.545 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 7.5 mm-40 -75.01 -21.41 59.13 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.248 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -84.12 -60.69 2.02 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.478 -0.764 . . . . 0.0 109.652 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -52.51 -32.42 40.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.463 -0.773 . . . . 0.0 109.282 179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.11 -36.11 27.88 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.643 -0.661 . . . . 0.0 109.646 179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -72.84 -56.79 4.7 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.3 -0.875 . . . . 0.0 109.995 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.05 -42.06 72.21 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.437 -0.789 . . . . 0.0 110.35 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -59.03 -37.24 76.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.311 -0.868 . . . . 0.0 109.936 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -81.01 -27.64 35.77 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.374 -0.829 . . . . 0.0 109.938 179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -72.73 -27.73 62.22 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.404 -0.81 . . . . 0.0 110.124 179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.06 -31.67 21.82 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.355 -0.84 . . . . 0.0 110.156 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -77.54 -27.96 51.74 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.392 -0.818 . . . . 0.0 110.244 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.2 m -91.97 -27.26 17.96 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.334 -0.854 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -80.05 -32.96 39.39 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.452 -0.78 . . . . 0.0 110.205 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.3 -12.7 56.38 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.31 -0.869 . . . . 0.0 110.535 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -80.55 -50.24 10.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.275 -0.891 . . . . 0.0 110.26 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -120.63 32.01 6.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.307 -0.871 . . . . 0.0 110.3 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -116.39 -34.26 1.34 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 14.2 tt -97.6 -19.42 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.393 -1.063 . . . . 0.0 110.413 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.38 118.62 10.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.223 -0.923 . . . . 0.0 110.272 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 5.8 t -63.01 155.61 27.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.374 -0.829 . . . . 0.0 110.217 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.7 m -98.15 128.43 44.64 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.3 -0.875 . . . . 0.0 110.169 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -138.91 -98.37 0.42 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.51 HG23 ' O ' ' A' ' 59' ' ' THR . 6.4 t -160.7 66.41 0.32 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.393 -1.063 . . . . 0.0 110.204 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' O ' ' N ' ' A' ' 62' ' ' SER . 7.1 mt-10 -143.79 43.43 1.47 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.444 -0.785 . . . . 0.0 110.46 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.648 ' O ' ' N ' ' A' ' 63' ' ' ASP . 23.2 m-20 -55.67 97.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.306 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.766 ' HB3' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -51.09 76.81 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.598 0.713 . . . . 0.0 110.807 -177.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.648 ' N ' ' O ' ' A' ' 61' ' ' ASP . 31.6 m-20 -73.66 -44.94 55.44 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.696 -0.627 . . . . 0.0 110.085 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -75.0 -25.83 59.11 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.274 -0.891 . . . . 0.0 109.242 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.766 ' HB3' ' HB3' ' A' ' 62' ' ' SER . . . -64.37 -41.12 96.87 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.533 -0.867 . . . . 0.0 108.715 179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 66' ' ' LEU . 11.3 tp -68.13 -28.77 67.6 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.1 tt -78.04 -39.48 41.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.595 -0.69 . . . . 0.0 110.01 179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' A' ' 71' ' ' ILE . 0.0 OUTLIER -84.34 -51.99 6.55 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.375 -179.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.2 tmm? -55.92 -41.07 74.01 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.303 -0.873 . . . . 0.0 110.628 -179.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 94.6 m -71.56 -41.03 69.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.26 -0.9 . . . . 0.0 110.74 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' A' ' 68' ' ' LYS . 5.8 tp -80.96 -18.44 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 O-C-N 121.083 -1.01 . . . . 0.0 110.099 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.1 t -73.22 -42.33 62.75 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.336 -0.852 . . . . 0.0 109.575 179.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -76.63 -26.58 55.07 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.548 -0.72 . . . . 0.0 110.062 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.62 -51.08 5.71 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.464 -0.772 . . . . 0.0 110.335 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.41 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 3.6 tm-20 -71.15 -10.23 59.41 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.351 -0.843 . . . . 0.0 110.559 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -49.74 99.57 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.201 -0.937 . . . . 0.0 110.542 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.63 -59.73 0.51 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -85.06 115.77 23.06 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.384 -1.068 . . . . 0.0 110.171 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.0 m -144.95 44.37 1.35 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.443 -0.786 . . . . 0.0 110.221 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -99.97 25.54 27.9 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -171.57 148.79 2.32 Favored Pre-proline 0 N--CA 1.486 1.369 0 O-C-N 121.268 -1.137 . . . . 0.0 108.942 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.34 38.67 0.62 Allowed 'Trans proline' 0 C--N 1.304 -1.805 0 O-C-N 123.52 1.274 . . . . 0.0 110.737 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.79 92.5 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.114 -0.991 . . . . 0.0 110.476 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 41.2 mt -52.89 -30.24 32.99 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.323 -0.861 . . . . 0.0 110.472 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.21 -18.87 65.62 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.0 p -84.83 -28.38 26.12 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.282 -0.886 . . . . 0.0 110.142 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . 0.408 ' HB3' ' CG ' ' A' ' 92' ' ' GLN . 30.4 mtt -76.29 118.16 18.71 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.35 -0.844 . . . . 0.0 110.088 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 79.4 p -79.87 -163.32 0.52 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.381 -0.825 . . . . 0.0 110.607 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.493 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 15.0 pt-20 -67.09 -32.11 73.05 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.526 -0.734 . . . . 0.0 109.303 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.5 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 24.6 mt-10 -85.17 -39.75 17.49 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.4 ' O ' ' HB3' ' A' ' 94' ' ' ALA . 1.4 tp10 -63.9 -46.05 86.58 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.711 ' HB3' HG13 ' B' ' 70' ' ' VAL . 58.7 mt-30 -65.96 -34.8 78.94 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 107.718 -1.215 . . . . 0.0 107.718 177.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.5 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -59.4 -39.53 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 178.192 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 91' ' ' GLU . . . -59.53 -30.41 68.58 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.74 ' CD2' HD13 ' B' ' 8' ' ' LEU . 21.4 t80 -67.81 -37.14 81.59 Favored 'General case' 0 N--CA 1.488 1.464 0 CA-C-O 121.556 0.693 . . . . 0.0 109.139 178.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.792 ' HB1' ' HB ' ' B' ' 44' ' ' ILE . . . -78.77 -35.55 44.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.685 -0.635 . . . . 0.0 110.089 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 1.9 mtt -80.37 -22.79 40.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.404 -0.81 . . . . 0.0 109.917 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -80.96 -43.63 19.42 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.262 -0.899 . . . . 0.0 110.518 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -17.87 56.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.385 -0.822 . . . . 0.0 110.603 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.0 m -90.29 -23.79 21.08 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.95 . . . . 0.0 110.318 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 8.4 tp -87.71 10.87 16.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.221 -0.925 . . . . 0.0 110.475 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -94.44 -61.95 1.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.236 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 111.77 88.42 1.8 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -118.37 93.08 3.99 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.328 -1.101 . . . . 0.0 110.242 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.51 53.44 0.74 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.437 -0.789 . . . . 0.0 110.141 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -117.71 -48.89 2.56 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.353 -0.842 . . . . 0.0 110.239 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 100.94 -121.54 7.28 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.13 87.1 4.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.294 -1.121 . . . . 0.0 110.183 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -92.58 80.66 4.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.292 -0.88 . . . . 0.0 110.243 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 52.29 55.54 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.36 -0.838 . . . . 0.0 110.446 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -81.23 -47.44 13.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.309 -0.87 . . . . 0.0 110.255 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.251 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.439 ' O ' ' HA ' ' B' ' 16' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.171 0.51 . . . . 0.0 110.347 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 17.5 mt-30 -103.77 132.56 49.91 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.455 -0.778 . . . . 0.0 109.522 179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 8.1 pt -137.03 155.07 32.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.21 -0.931 . . . . 0.0 110.081 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.409 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 85.3 m-85 -111.73 145.25 39.65 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.638 -0.664 . . . . 0.0 111.084 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.95 121.81 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.464 -0.773 . . . . 0.0 109.561 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.0 mttm -100.44 129.65 46.43 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.406 -0.809 . . . . 0.0 110.343 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 71.1 p -95.99 177.03 5.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.455 -0.778 . . . . 0.0 110.251 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.74 HD13 ' CD2' ' A' ' 95' ' ' TYR . 4.5 mm? -61.09 -16.74 47.33 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.487 -0.758 . . . . 0.0 110.858 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.7 p -95.97 21.6 8.48 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.165 -0.959 . . . . 0.0 110.694 -179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.07 14.85 57.37 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.324 -1.11 . . . . 0.0 110.324 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -84.82 131.93 34.47 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.147 -1.207 . . . . 0.0 109.749 179.669 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 44.8 m -112.86 127.85 56.29 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.249 -0.907 . . . . 0.0 110.348 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.409 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 0.5 OUTLIER -109.79 140.54 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.388 -0.82 . . . . 0.0 110.416 -179.912 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . 0.725 ' C ' HD12 ' B' ' 15' ' ' LEU . 6.6 m -101.65 114.7 28.97 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 108.879 178.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.725 HD12 ' C ' ' B' ' 14' ' ' THR . 10.0 mp -123.1 156.21 35.41 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.192 -0.943 . . . . 0.0 111.282 -178.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 1' ' ' MET . 2.1 tt0 -106.24 120.56 42.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.512 -0.742 . . . . 0.0 109.091 179.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.428 ' O ' ' HG2' ' B' ' 1' ' ' MET . 32.7 m -140.6 178.75 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.171 -0.955 . . . . 0.0 111.353 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.44 ' O ' HD12 ' B' ' 56' ' ' LEU . 20.6 mt-10 -113.67 158.39 38.97 Favored Pre-proline 0 N--CA 1.49 1.53 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -73.02 -25.15 16.53 Favored 'Trans proline' 0 C--N 1.305 -1.735 0 O-C-N 123.42 1.221 . . . . 0.0 110.184 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.9 p -84.76 -4.58 59.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.101 -0.999 . . . . 0.0 110.296 179.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -71.08 144.68 50.24 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.149 -0.969 . . . . 0.0 110.522 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.1 p -83.27 159.67 21.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.547 -0.72 . . . . 0.0 110.495 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.634 HG23 HD12 ' B' ' 43' ' ' LEU . 42.7 mm -59.68 -32.86 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.34 -0.85 . . . . 0.0 109.606 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.77 -38.01 86.43 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.459 -0.776 . . . . 0.0 109.431 179.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -70.6 -31.43 68.42 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.423 -0.798 . . . . 0.0 109.333 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.571 HG21 HD21 ' B' ' 56' ' ' LEU . 68.0 t -69.72 -42.18 80.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.094 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -63.05 -38.68 92.15 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.361 -0.837 . . . . 0.0 109.094 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.72 -37.73 85.28 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.52 -0.737 . . . . 0.0 109.491 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.1 mttm -67.96 -36.7 80.52 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.387 -0.82 . . . . 0.0 109.388 179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.604 HD13 HD12 ' B' ' 69' ' ' LEU . 22.8 mt -66.88 -40.83 86.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.398 -0.814 . . . . 0.0 109.098 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' B' ' 35' ' ' GLY . 1.3 tm0? -60.39 -44.63 95.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.511 -0.743 . . . . 0.0 109.28 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.54 -32.7 69.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.519 -0.738 . . . . 0.0 110.488 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 5.0 mptt -83.38 -38.1 22.42 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.205 -0.934 . . . . 0.0 111.219 -179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -107.93 -55.65 2.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.047 -1.033 . . . . 0.0 110.518 -179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' B' ' 31' ' ' GLN . . . 123.89 21.23 2.41 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.044 -1.222 . . . . 0.0 110.044 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.5 HG23 ' HD2' ' B' ' 37' ' ' PRO . 19.7 mt -91.47 144.21 29.3 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.157 -1.202 . . . . 0.0 109.797 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.5 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.4 Cg_endo -69.51 130.84 20.36 Favored 'Trans proline' 0 C--N 1.31 -1.49 0 O-C-N 123.524 1.276 . . . . 0.0 110.248 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.65 -24.04 77.47 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 O-C-N 123.748 1.394 . . . . 0.0 110.778 -179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -68.99 -25.85 64.72 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.277 -0.889 . . . . 0.0 109.629 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.415 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 4.6 mm100 -101.25 2.27 39.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.483 -0.761 . . . . 0.0 110.429 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -94.48 138.67 32.12 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.705 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.493 ' CZ ' HD11 ' A' ' 93' ' ' ILE . 4.9 mtt-85 -130.14 129.9 44.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.582 -0.699 . . . . 0.0 109.419 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.784 ' C ' HD12 ' B' ' 44' ' ' ILE . 16.9 mt -104.64 125.09 50.43 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.169 -0.957 . . . . 0.0 110.731 -179.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.792 ' HB ' ' HB1' ' A' ' 96' ' ' ALA . 1.9 mp -121.14 134.83 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.61 -0.681 . . . . 0.0 109.742 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 67' ' ' LEU . 77.7 t80 -140.75 141.46 34.87 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.34 -0.85 . . . . 0.0 109.914 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.51 28.6 0.52 Allowed 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.52 -0.737 . . . . 0.0 111.32 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.19 4.22 90.52 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 110.499 -1.041 . . . . 0.0 110.499 179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -111.0 130.55 55.55 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.103 -1.233 . . . . 0.0 110.264 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.2 132.65 37.67 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.226 -0.921 . . . . 0.0 109.405 179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.782 HD22 ' CG ' ' B' ' 59' ' ' TYR . 27.1 mt -83.89 136.91 33.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.381 -0.825 . . . . 0.0 110.32 -179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -93.52 133.95 36.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.481 -0.762 . . . . 0.0 110.486 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.506 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 66.3 m-20 -48.38 -27.1 2.39 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.516 -0.74 . . . . 0.0 111.101 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -82.99 -9.03 84.93 Favored Glycine 0 N--CA 1.494 2.514 0 C-N-CA 120.168 -1.015 . . . . 0.0 110.667 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -99.43 157.77 16.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.052 -1.264 . . . . 0.0 110.582 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 61.0 p -102.19 163.32 12.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.374 -0.828 . . . . 0.0 110.32 179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.715 ' HA ' HD12 ' B' ' 61' ' ' ILE . 98.1 mt -53.77 -46.44 70.98 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.319 -0.863 . . . . 0.0 110.734 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 44.7 p -56.69 -33.3 66.31 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.4 -0.812 . . . . 0.0 111.207 -179.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -59.39 -27.39 65.95 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.171 -0.956 . . . . 0.0 110.209 -179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.782 ' CG ' HD22 ' B' ' 50' ' ' LEU . 80.2 m-85 -101.16 26.49 7.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.405 -0.809 . . . . 0.0 110.037 179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 19.0 m120 50.75 35.79 12.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.5 -0.75 . . . . 0.0 110.995 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.715 HD12 ' HA ' ' B' ' 56' ' ' LEU . 86.0 mt -81.64 110.43 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.283 -0.885 . . . . 0.0 109.953 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -105.73 172.4 6.82 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.374 -0.829 . . . . 0.0 110.134 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -45.85 152.6 0.35 Allowed 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.491 -0.756 . . . . 0.0 111.504 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.46 13.9 8.47 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.701 178.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -71.37 138.52 49.26 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.057 -1.027 . . . . 0.0 110.112 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 88.1 m -107.56 114.59 28.68 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.285 -0.885 . . . . 0.0 110.107 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.3 mt -102.6 160.15 14.82 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.379 -0.826 . . . . 0.0 110.207 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 60.9 m80 -108.66 135.27 50.18 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.322 -0.862 . . . . 0.0 109.577 179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.621 HD23 ' N ' ' B' ' 70' ' ' VAL . 6.9 tt -107.26 132.86 52.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.22 -0.925 . . . . 0.0 110.651 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.711 HG13 ' HB3' ' A' ' 92' ' ' GLN . 85.6 t -125.3 159.99 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.472 -0.767 . . . . 0.0 110.096 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 58.1 mt -94.15 125.34 38.73 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.436 -0.79 . . . . 0.0 110.189 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.404 ' HB3' ' HA ' ' B' ' 40' ' ' GLN . 12.0 ttt180 -101.55 107.12 18.31 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.32 -0.863 . . . . 0.0 110.275 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 2.9 mt -99.19 145.74 26.89 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.375 -0.828 . . . . 0.0 110.09 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -166.32 123.58 1.36 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.312 -0.867 . . . . 0.0 110.218 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 77.54 91.32 0.29 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.301 0 CA-C-O 117.977 -1.457 . . . . 0.0 109.558 179.943 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.312 0.577 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.7 ttm -74.52 -164.42 0.27 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.287 -0.883 . . . . 0.0 110.173 179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mp -111.66 24.38 12.81 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.379 -0.826 . . . . 0.0 109.482 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.59 -121.32 0.67 Allowed Glycine 0 N--CA 1.487 2.073 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.2 tp 52.53 34.54 15.71 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.302 -1.117 . . . . 0.0 110.418 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -126.78 163.81 20.56 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.02 -34.8 4.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.344 -1.092 . . . . 0.0 110.309 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t -60.23 -30.13 69.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.413 -0.804 . . . . 0.0 110.136 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.66 -27.15 68.47 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.276 -0.89 . . . . 0.0 110.19 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.555 ' CD2' HG21 ' A' ' 14' ' ' VAL . 28.3 t80 -111.08 -20.52 12.35 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.429 -0.795 . . . . 0.0 110.252 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.422 ' HG3' ' HB2' ' A' ' 18' ' ' ALA . 24.2 tt0 -95.29 51.58 1.34 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.223 -0.923 . . . . 0.0 110.378 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -168.76 -52.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.319 -0.863 . . . . 0.0 110.323 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -84.21 -24.06 49.29 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.834 -1.307 . . . . 0.0 109.834 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.555 HG21 ' CD2' ' A' ' 10' ' ' PHE . 59.6 t -76.43 -67.24 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.274 -1.133 . . . . 0.0 110.32 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 17' ' ' SER . 30.0 p30 -116.87 161.75 30.79 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.275 -0.891 . . . . 0.0 110.063 -179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.426 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 36.2 Cg_endo -58.46 73.22 0.04 OUTLIER 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.863 1.454 . . . . 0.0 111.767 -178.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.51 ' N ' ' O ' ' A' ' 15' ' ' ASP . 0.3 OUTLIER 63.75 34.78 11.78 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-O 121.659 0.743 . . . . 0.0 109.277 179.669 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.422 ' HB2' ' HG3' ' A' ' 11' ' ' GLU . . . 38.22 33.3 0.06 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.354 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.65 117.37 0.54 Allowed Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.299 -0.876 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -71.44 -13.4 30.37 Favored 'Trans proline' 0 C--N 1.307 -1.623 0 O-C-N 123.999 1.526 . . . . 0.0 110.158 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -77.82 -32.89 52.5 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.408 -0.807 . . . . 0.0 109.655 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.32 -24.86 21.9 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.464 -0.773 . . . . 0.0 109.624 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' HB2' ' A' ' 16' ' ' PRO . . . -79.92 -41.53 25.92 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.391 -0.818 . . . . 0.0 109.682 179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.69 ' O ' HD23 ' A' ' 24' ' ' LEU . 2.4 tt -77.01 -30.86 56.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.439 -0.788 . . . . 0.0 109.824 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -69.06 -37.0 78.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.461 -0.774 . . . . 0.0 109.926 179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 26' ' ' LEU . 56.6 tp -78.01 -21.45 50.8 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.334 -0.854 . . . . 0.0 110.191 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.0 -31.7 34.56 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.307 -0.87 . . . . 0.0 109.113 179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 24' ' ' LEU . 79.3 t -79.28 -28.95 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.776 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.92 -48.04 22.84 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.409 -0.807 . . . . 0.0 110.033 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 4.7 tmm? -64.59 -36.35 83.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.0 110.018 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -75.25 -38.59 60.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.453 -0.779 . . . . 0.0 110.122 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -61.92 -49.27 76.84 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.35 -0.844 . . . . 0.0 109.914 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -63.61 -27.56 69.32 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.338 -0.851 . . . . 0.0 110.061 179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.94 -44.45 54.94 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.377 -0.827 . . . . 0.0 110.141 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -60.48 -40.37 91.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.377 -0.827 . . . . 0.0 110.238 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 48.6 mtt-85 -67.93 -45.73 73.52 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.42 -0.8 . . . . 0.0 110.184 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.0 OUTLIER -74.89 -20.68 59.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.416 -0.802 . . . . 0.0 110.258 179.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -84.0 -56.35 3.73 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.411 -0.805 . . . . 0.0 109.571 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -53.22 -32.82 50.1 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.409 -0.807 . . . . 0.0 109.131 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -83.95 -35.47 23.97 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.734 -0.604 . . . . 0.0 109.553 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -71.4 -57.13 4.73 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.348 -0.845 . . . . 0.0 109.955 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.45 -44.24 80.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.44 -0.787 . . . . 0.0 110.324 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.1 ttt-85 -54.93 -37.66 66.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.29 -0.881 . . . . 0.0 109.893 179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -77.4 -29.05 52.93 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.324 -0.86 . . . . 0.0 109.784 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.549 ' O ' ' HB2' ' A' ' 49' ' ' ALA . . . -77.43 -28.34 52.49 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.328 -0.858 . . . . 0.0 110.075 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.17 -43.8 12.72 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.413 -0.805 . . . . 0.0 110.159 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.63 70.83 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.394 -0.816 . . . . 0.0 110.313 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.1 t -91.73 -27.91 17.75 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.273 -0.892 . . . . 0.0 110.312 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 45' ' ' ALA . . . -64.93 -27.87 69.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.39 -0.819 . . . . 0.0 110.263 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.849 ' O ' ' HB2' ' A' ' 55' ' ' ALA . . . -89.2 -19.83 24.94 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.346 -0.846 . . . . 0.0 110.376 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HA ' ' CB ' ' A' ' 55' ' ' ALA . 0.9 OUTLIER -103.8 28.22 6.82 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.852 . . . . 0.0 110.177 -179.927 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -168.9 -40.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.363 -0.836 . . . . 0.0 110.146 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.97 -53.32 15.36 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.9 tp -111.69 -17.6 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.339 -1.095 . . . . 0.0 110.419 -179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.849 ' HB2' ' O ' ' A' ' 50' ' ' ALA . . . -68.88 -164.02 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.257 -0.902 . . . . 0.0 110.128 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 6.7 t -112.15 154.49 25.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.36 -0.837 . . . . 0.0 110.206 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 19.5 m -79.58 93.14 5.41 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.412 -0.805 . . . . 0.0 110.29 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.494 ' O ' HG23 ' A' ' 59' ' ' THR . . . -151.2 -143.83 3.79 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 58' ' ' GLY . 16.0 p -153.51 97.61 2.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.307 -1.113 . . . . 0.0 110.259 179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -106.1 45.25 0.98 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.333 -0.855 . . . . 0.0 110.218 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -130.51 -41.45 1.21 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.443 -0.786 . . . . 0.0 110.253 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -118.13 79.54 1.39 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.375 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -56.19 -29.54 61.02 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.304 -0.872 . . . . 0.0 110.212 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.74 -30.56 59.26 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.249 -0.907 . . . . 0.0 109.046 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.59 -44.4 96.3 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.617 -0.833 . . . . 0.0 108.981 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.46 -30.53 71.57 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.6 tt -75.3 -35.84 61.21 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.566 -0.708 . . . . 0.0 109.719 179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 71' ' ' ILE . 2.2 mptp? -82.61 -57.6 3.27 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.513 -0.742 . . . . 0.0 110.326 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 39.8 mtt -52.27 -35.96 51.49 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.169 -0.957 . . . . 0.0 110.747 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 54.6 m -73.47 -39.56 64.81 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.207 -0.933 . . . . 0.0 110.364 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 68' ' ' LYS . 3.4 tp -78.4 -23.26 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.187 -0.945 . . . . 0.0 109.589 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.0 p -68.86 -45.05 72.05 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.399 -0.813 . . . . 0.0 109.563 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -85.35 -7.18 59.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.517 179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -110.51 -17.08 13.52 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.084 -1.01 . . . . 0.0 110.785 -179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' CB ' ' O ' ' A' ' 71' ' ' ILE . 26.4 tt0 -107.26 -15.61 14.61 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.096 -1.003 . . . . 0.0 110.969 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.484 ' CG ' ' O ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -84.18 43.07 0.92 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.082 -1.012 . . . . 0.0 111.094 -179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.93 -84.32 0.1 OUTLIER Glycine 0 N--CA 1.492 2.411 0 N-CA-C 109.649 -1.381 . . . . 0.0 109.649 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -71.8 -35.48 69.98 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.419 -1.048 . . . . 0.0 110.308 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.656 HG22 ' O ' ' A' ' 79' ' ' THR . 88.9 m 52.56 25.15 3.45 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.393 -0.817 . . . . 0.0 110.158 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.46 ' O ' HD23 ' A' ' 81' ' ' LEU . . . 94.72 -89.0 1.18 Allowed Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.331 -1.508 . . . . 0.0 109.331 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 80' ' ' GLY . 94.5 mt -152.26 146.26 18.29 Favored Pre-proline 0 C--N 1.305 -1.348 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -77.54 36.98 0.58 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 123.368 1.194 . . . . 0.0 110.807 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 50.43 62.16 2.83 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.218 -0.926 . . . . 0.0 110.62 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.606 HD21 HD22 ' B' ' 8' ' ' LEU . 8.5 mt -60.88 -36.38 79.04 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.34 -0.85 . . . . 0.0 110.184 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 80.6 p -74.44 -3.6 31.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.402 -0.811 . . . . 0.0 110.633 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -117.34 11.95 14.14 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.164 -0.96 . . . . 0.0 110.13 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 2.3 mtm -94.76 -163.83 1.09 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.249 -0.907 . . . . 0.0 109.918 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 61.3 p -136.54 179.41 6.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.42 -0.8 . . . . 0.0 110.318 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.596 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 6.1 pt-20 -62.58 -30.88 71.65 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.488 -0.758 . . . . 0.0 109.473 179.68 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.502 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 30.1 mt-10 -84.17 -42.68 15.74 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.335 179.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -63.02 -40.66 98.43 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 107.942 -1.132 . . . . 0.0 107.942 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.49 ' HB3' HG13 ' B' ' 70' ' ' VAL . 75.1 mt-30 -70.69 -36.37 73.25 Favored 'General case' 0 N--CA 1.487 1.381 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.614 HD11 ' NE ' ' B' ' 42' ' ' ARG . 0.1 OUTLIER -60.64 -43.02 93.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.457 ' N ' HG22 ' A' ' 93' ' ' ILE . . . -56.15 -34.38 66.08 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.881 ' CD2' HD23 ' B' ' 8' ' ' LEU . 23.9 t80 -60.86 -48.67 80.74 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.295 0.569 . . . . 0.0 109.975 179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB1' ' HB3' ' B' ' 68' ' ' HIS . . . -78.04 -27.93 48.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.522 -0.736 . . . . 0.0 110.3 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 93' ' ' ILE . 0.0 OUTLIER -80.93 -24.3 38.27 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.274 -0.891 . . . . 0.0 109.592 179.681 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.34 -21.6 28.84 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.45 -0.781 . . . . 0.0 110.314 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 31.5 ttm -97.07 -14.78 21.35 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.237 -0.914 . . . . 0.0 110.662 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.9 t -100.65 -39.94 7.63 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.168 -0.957 . . . . 0.0 110.379 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.827 ' O ' HD13 ' A' ' 101' ' ' LEU . 1.6 tm? -59.56 -31.37 69.37 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.379 -0.826 . . . . 0.0 109.961 179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.83 75.44 1.45 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.339 -0.851 . . . . 0.0 110.304 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -111.35 84.13 0.35 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -79.59 81.04 5.91 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.387 -1.066 . . . . 0.0 110.202 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -140.99 32.79 1.76 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.34 -0.85 . . . . 0.0 110.215 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -109.31 39.27 2.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.38 -0.825 . . . . 0.0 110.2 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -122.27 76.49 0.35 Allowed Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -108.16 60.96 0.61 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.198 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.44 74.13 4.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.439 -0.788 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -151.78 107.84 3.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.385 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 14.7 p -110.5 -40.0 4.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.374 -0.829 . . . . 0.0 110.124 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.997 -1.001 . . . . 0.0 110.165 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.434 ' HB3' ' O ' ' B' ' 17' ' ' VAL . 45.1 ttp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.26 0.552 . . . . 0.0 110.329 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -99.33 140.44 33.5 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.339 -0.851 . . . . 0.0 109.83 179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 28.5 pt -137.43 156.31 32.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.182 -0.949 . . . . 0.0 110.35 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . 0.403 ' HA ' ' O ' ' B' ' 13' ' ' ILE . 82.7 m-85 -111.65 143.16 42.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.62 -0.675 . . . . 0.0 110.792 -179.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' ' HA ' ' B' ' 12' ' ' THR . 94.9 t -128.42 123.15 59.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.462 -0.774 . . . . 0.0 109.545 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' B' ' 11' ' ' LYS . 3.6 mttt -99.92 130.6 46.11 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.337 -0.852 . . . . 0.0 110.486 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.452 HG22 HD23 ' B' ' 69' ' ' LEU . 68.5 p -95.74 178.41 5.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.316 -0.865 . . . . 0.0 110.413 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.881 HD23 ' CD2' ' A' ' 95' ' ' TYR . 5.8 mt -61.7 -14.53 32.48 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.495 -0.753 . . . . 0.0 110.97 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 64.6 p -95.79 16.74 16.71 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.12 -0.987 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.07 10.25 58.76 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 110.215 -1.154 . . . . 0.0 110.215 179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 3.7 tttp -84.9 133.15 34.3 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.1 -1.235 . . . . 0.0 109.772 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 20.8 m -113.27 130.1 56.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.232 -0.917 . . . . 0.0 110.414 -179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.403 ' O ' ' HA ' ' B' ' 4' ' ' PHE . 52.3 mt -109.12 140.23 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.456 -0.778 . . . . 0.0 110.363 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 33.4 m -101.9 121.46 42.16 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.469 -0.769 . . . . 0.0 109.164 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.5 HD11 HG12 ' B' ' 30' ' ' ILE . 69.2 mt -123.17 156.06 35.83 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.166 -0.959 . . . . 0.0 110.981 -179.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.21 112.9 26.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.486 -0.758 . . . . 0.0 109.289 179.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.594 HG12 ' CD ' ' B' ' 29' ' ' LYS . 34.1 m -140.09 178.7 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.347 -0.846 . . . . 0.0 110.808 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.477 ' O ' HD12 ' B' ' 56' ' ' LEU . 45.8 mt-10 -113.13 164.04 16.59 Favored Pre-proline 0 C--N 1.303 -1.416 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.37 -25.75 21.3 Favored 'Trans proline' 0 C--N 1.307 -1.643 0 O-C-N 123.378 1.199 . . . . 0.0 110.195 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -84.51 -3.25 58.3 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.273 -0.892 . . . . 0.0 110.668 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -71.1 144.08 50.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.487 -179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 73.8 p -83.31 159.18 21.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.577 -0.702 . . . . 0.0 110.589 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.689 HG22 ' HE2' ' B' ' 27' ' ' LYS . 45.9 mm -59.63 -36.65 66.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.358 -0.839 . . . . 0.0 109.383 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -60.08 -35.03 74.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.48 -0.762 . . . . 0.0 109.355 179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -33.42 71.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.516 -0.74 . . . . 0.0 109.219 179.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.12 -41.15 78.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.451 -0.781 . . . . 0.0 109.298 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.689 ' HE2' HG22 ' B' ' 23' ' ' ILE . 8.8 mtmt -62.94 -41.08 99.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.465 -0.772 . . . . 0.0 109.072 179.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.61 -33.94 74.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.518 -0.739 . . . . 0.0 109.364 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.594 ' CD ' HG12 ' B' ' 17' ' ' VAL . 30.6 mttp -68.27 -40.84 81.76 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.443 -0.786 . . . . 0.0 109.536 179.418 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 15' ' ' LEU . 14.3 mt -66.42 -37.43 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 119.516 -0.873 . . . . 0.0 108.947 179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.01 -46.62 90.02 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.356 -0.84 . . . . 0.0 109.283 178.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.22 -31.47 67.38 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.426 -0.796 . . . . 0.0 110.453 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.406 ' HD2' ' O ' ' B' ' 29' ' ' LYS . 5.5 mptt -83.42 -37.64 22.95 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 111.107 -179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -108.16 -57.71 2.08 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.166 -0.959 . . . . 0.0 110.422 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 126.88 21.36 1.74 Allowed Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 37' ' ' PRO . 44.2 mt -91.38 143.87 28.87 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.171 -1.193 . . . . 0.0 109.812 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.493 ' HD2' HG23 ' B' ' 36' ' ' ILE . 41.2 Cg_endo -68.0 130.93 22.62 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.617 1.325 . . . . 0.0 110.161 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -60.21 -25.25 79.57 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.606 1.319 . . . . 0.0 110.858 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.95 -24.25 64.24 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.303 -0.873 . . . . 0.0 109.701 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.412 ' HG3' ' HG2' ' B' ' 37' ' ' PRO . 8.6 mt-30 -101.52 0.99 37.55 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.424 -0.797 . . . . 0.0 110.603 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' B' ' 37' ' ' PRO . 5.6 mt-30 -94.1 137.81 32.86 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.167 -0.958 . . . . 0.0 110.472 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.614 ' NE ' HD11 ' A' ' 93' ' ' ILE . 3.2 ttt85 -130.14 132.67 46.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.374 -0.829 . . . . 0.0 109.723 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.78 ' HB3' HD12 ' B' ' 50' ' ' LEU . 12.6 mt -104.53 128.51 52.5 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.0 110.105 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.465 HG13 ' HB3' ' A' ' 96' ' ' ALA . 12.1 mm -120.86 135.58 60.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.635 -0.666 . . . . 0.0 110.185 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.574 ' HB2' HD23 ' B' ' 67' ' ' LEU . 69.3 t80 -140.97 135.66 31.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.367 -0.833 . . . . 0.0 109.569 179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.59 32.4 1.15 Allowed 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.48 -0.762 . . . . 0.0 111.267 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.516 ' HA3' HD23 ' A' ' 101' ' ' LEU . . . 79.9 4.52 89.56 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 110.732 -0.947 . . . . 0.0 110.732 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -110.99 129.63 55.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.017 -1.284 . . . . 0.0 110.241 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.99 137.06 38.09 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 109.531 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.78 HD12 ' HB3' ' B' ' 43' ' ' LEU . 22.2 mt -83.97 140.16 32.1 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.245 -0.909 . . . . 0.0 110.323 -179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.7 131.88 38.6 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.377 -0.827 . . . . 0.0 110.578 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.453 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 69.1 m-20 -48.23 -29.75 4.08 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.537 -0.727 . . . . 0.0 111.27 179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.1 -6.1 88.5 Favored Glycine 0 N--CA 1.495 2.573 0 C-N-CA 120.152 -1.023 . . . . 0.0 110.686 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.34 156.46 16.99 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.995 -1.297 . . . . 0.0 110.441 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 75.3 p -102.64 165.38 11.11 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.372 -0.83 . . . . 0.0 110.085 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.492 HD22 HG21 ' B' ' 61' ' ' ILE . 74.3 mt -53.4 -48.43 68.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.249 -0.907 . . . . 0.0 110.65 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -56.86 -34.98 68.35 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.399 -0.813 . . . . 0.0 111.137 -179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.51 -28.69 67.28 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.142 -0.974 . . . . 0.0 110.406 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.549 ' CG ' HD22 ' B' ' 50' ' ' LEU . 27.4 m-85 -101.29 29.21 4.87 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.863 . . . . 0.0 109.906 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 4.7 m120 50.86 26.47 2.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.505 -0.747 . . . . 0.0 110.825 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.492 HG21 HD22 ' B' ' 56' ' ' LEU . 84.9 mt -81.35 108.96 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.351 -0.843 . . . . 0.0 109.787 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -105.52 173.75 6.17 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.361 -0.837 . . . . 0.0 110.354 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 5.8 ptpp? -46.55 152.96 0.41 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.583 -0.698 . . . . 0.0 111.061 -179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.2 mt-10 62.52 17.12 9.32 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.667 -0.646 . . . . 0.0 110.479 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.34 141.82 50.42 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.233 -0.917 . . . . 0.0 110.086 179.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 34.6 m -107.68 106.54 16.93 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.342 -0.849 . . . . 0.0 109.928 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.574 HD23 ' HB2' ' B' ' 45' ' ' PHE . 4.1 mt -102.2 160.48 14.49 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.413 -0.804 . . . . 0.0 110.177 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.505 ' HB3' ' HB1' ' A' ' 96' ' ' ALA . 46.6 m80 -108.57 140.36 42.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.43 -0.794 . . . . 0.0 109.828 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.452 HD23 HG22 ' B' ' 7' ' ' THR . 61.6 tp -107.59 132.82 52.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.116 -0.99 . . . . 0.0 110.519 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.49 HG13 ' HB3' ' A' ' 92' ' ' GLN . 24.4 t -124.79 154.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.398 -0.814 . . . . 0.0 109.791 179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 14.5 mt -93.88 103.8 15.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.367 -0.833 . . . . 0.0 110.213 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -84.42 94.3 8.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.322 -0.861 . . . . 0.0 110.156 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -117.67 144.85 44.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.302 -0.874 . . . . 0.0 110.289 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 1.3 mtt85 -71.1 96.64 1.37 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.38 -0.825 . . . . 0.0 110.118 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.29 156.0 15.94 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.364 0 CA-C-O 118.046 -1.419 . . . . 0.0 109.632 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 62.7 t60 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.207 0.527 . . . . 0.0 110.158 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.456 ' C ' HD22 ' A' ' 3' ' ' LEU . 2.0 ttp -160.86 -172.6 3.55 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.355 -0.84 . . . . 0.0 110.16 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 3' ' ' LEU . 3.9 mm? -112.77 25.63 11.26 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.42 -0.8 . . . . 0.0 109.572 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.93 70.78 2.96 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.29 95.47 4.61 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.365 -1.08 . . . . 0.0 110.252 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -128.1 -98.8 0.97 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 -179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.07 46.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.301 -1.117 . . . . 0.0 110.223 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.5 m -150.11 24.99 0.82 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.356 -0.84 . . . . 0.0 110.363 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -112.22 -10.49 13.84 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.88 . . . . 0.0 110.502 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.577 ' HB2' HG11 ' A' ' 14' ' ' VAL . 46.4 p90 -131.65 36.12 3.76 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.179 -0.95 . . . . 0.0 110.355 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -117.93 37.47 3.96 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.392 -0.818 . . . . 0.0 110.123 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' CD2' ' N ' ' A' ' 13' ' ' GLY . 51.8 p90 -170.52 -37.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.362 -0.836 . . . . 0.0 110.481 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.434 ' N ' ' CD2' ' A' ' 12' ' ' PHE . . . -107.95 38.43 3.33 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 10' ' ' PHE . 31.9 m -128.97 -40.25 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.237 -1.155 . . . . 0.0 110.275 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.491 ' N ' HG23 ' A' ' 14' ' ' VAL . 0.7 OUTLIER -167.25 149.35 5.5 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.274 -0.891 . . . . 0.0 110.078 179.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -71.7 -14.71 30.22 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 123.794 1.418 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 43.7 p -74.73 -4.27 36.46 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.245 -0.909 . . . . 0.0 110.713 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.39 6.0 40.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.164 -0.96 . . . . 0.0 110.473 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -163.96 114.89 0.98 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.198 -0.939 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -70.15 -14.45 34.88 Favored 'Trans proline' 0 C--N 1.306 -1.673 0 O-C-N 123.979 1.515 . . . . 0.0 110.005 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.4 tt0 -73.69 -29.03 62.05 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.394 -0.817 . . . . 0.0 109.408 179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.487 HD22 ' N ' ' A' ' 22' ' ' LEU . 4.4 mm? -90.32 -28.43 18.75 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.596 -0.69 . . . . 0.0 109.451 179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.29 -42.17 59.98 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.4 -0.813 . . . . 0.0 109.848 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.569 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.8 tp -77.45 -34.4 54.46 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.436 -0.79 . . . . 0.0 109.879 179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB2' ' O ' ' A' ' 21' ' ' GLU . . . -63.76 -34.71 78.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.476 -0.765 . . . . 0.0 109.925 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.75 -21.52 37.83 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.381 -0.824 . . . . 0.0 110.163 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -80.48 -29.57 37.4 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.209 -0.932 . . . . 0.0 109.244 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 24' ' ' LEU . 65.1 t -81.53 -28.5 10.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.433 0 O-C-N 121.541 -0.725 . . . . 0.0 109.837 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 m -75.31 -42.38 54.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.387 -0.821 . . . . 0.0 110.028 179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.4 mmt -70.21 -31.66 69.2 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.408 -0.808 . . . . 0.0 110.095 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.96 -40.73 65.11 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.417 -0.802 . . . . 0.0 110.146 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.438 ' OE2' HG12 ' A' ' 28' ' ' VAL . 2.3 mt-10 -62.98 -41.95 99.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.322 -0.861 . . . . 0.0 110.184 179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -64.07 -35.37 80.51 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.29 -0.881 . . . . 0.0 110.087 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.32 -47.81 84.22 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.396 -0.815 . . . . 0.0 109.879 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.37 -28.98 68.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.402 -0.811 . . . . 0.0 109.838 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.93 -45.95 22.58 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.433 -0.792 . . . . 0.0 109.828 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.561 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 0.6 OUTLIER -68.15 -25.98 65.54 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.4 -0.812 . . . . 0.0 110.047 179.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -83.86 -59.1 2.53 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.836 . . . . 0.0 109.576 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.54 -31.25 45.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.412 -0.805 . . . . 0.0 109.168 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -83.08 -37.61 23.62 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.661 -0.649 . . . . 0.0 109.425 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.561 ' HB2' ' O ' ' A' ' 37' ' ' GLN . . . -69.18 -55.97 9.04 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.374 -0.829 . . . . 0.0 110.029 179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 6.4 mtt180 -57.68 -37.97 74.36 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 mmt180 -58.15 -38.36 76.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.294 -0.879 . . . . 0.0 109.818 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -79.36 -31.44 42.96 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.466 -0.771 . . . . 0.0 109.582 179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.65 -28.98 70.29 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.55 -0.719 . . . . 0.0 109.926 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -86.19 -37.64 18.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.429 -0.794 . . . . 0.0 110.044 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.78 -43.32 72.39 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.442 -0.786 . . . . 0.0 109.941 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.6 m -69.03 -45.66 69.91 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.485 -0.759 . . . . 0.0 110.213 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.29 -21.66 66.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.403 -0.811 . . . . 0.0 110.27 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.82 23.48 6.24 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.345 -0.847 . . . . 0.0 110.363 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -126.62 -45.32 1.63 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.824 . . . . 0.0 110.095 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.04 -33.68 9.62 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.468 -0.77 . . . . 0.0 110.159 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -70.25 -35.53 70.08 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.636 HG23 ' O ' ' A' ' 54' ' ' ILE . 6.8 tp -69.5 82.13 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.474 -1.015 . . . . 0.0 110.013 179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -49.4 148.24 2.82 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.444 -0.785 . . . . 0.0 110.602 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.9 m -61.81 139.38 58.35 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.475 -0.765 . . . . 0.0 110.395 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.48 -165.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.395 -0.816 . . . . 0.0 109.976 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -122.93 30.29 5.1 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 59' ' ' THR . 9.7 t -95.38 64.86 2.69 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.408 -1.054 . . . . 0.0 110.255 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -117.61 91.72 3.65 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.387 -0.821 . . . . 0.0 110.202 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.79 -43.21 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.257 -0.902 . . . . 0.0 110.341 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.1 70.72 0.98 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.299 -0.875 . . . . 0.0 110.277 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -77.02 -56.12 4.86 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.281 -0.887 . . . . 0.0 110.105 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -74.3 -26.41 60.16 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.237 -0.914 . . . . 0.0 109.175 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.89 -44.06 97.11 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.629 -0.828 . . . . 0.0 108.826 179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 66' ' ' LEU . 1.7 mm? -65.45 -29.53 70.22 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 67' ' ' LEU . 10.1 tt -77.87 -35.19 51.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.585 -0.697 . . . . 0.0 109.659 179.127 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 72' ' ' SER . 49.4 mmtt -82.63 -56.58 3.77 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.468 -0.77 . . . . 0.0 110.322 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 19.0 mtt -52.65 -43.28 65.37 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.171 -0.956 . . . . 0.0 110.551 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 86.1 m -66.53 -42.72 86.81 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.342 -0.849 . . . . 0.0 110.651 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.1 tp -84.08 -12.23 11.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.099 -1.001 . . . . 0.0 110.47 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 68' ' ' LYS . 9.7 t -76.72 -36.33 57.25 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.208 -0.933 . . . . 0.0 109.796 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -89.32 -25.04 21.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.451 -0.78 . . . . 0.0 110.045 179.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -85.82 -37.41 19.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.322 -0.861 . . . . 0.0 110.311 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -80.95 -43.73 19.27 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.372 -0.83 . . . . 0.0 110.332 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -78.39 109.93 12.99 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.428 -0.795 . . . . 0.0 110.325 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -127.73 78.99 0.38 Allowed Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 55.98 99.99 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.386 -1.067 . . . . 0.0 110.328 -179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -151.3 77.59 1.26 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.325 -0.859 . . . . 0.0 110.209 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -125.83 41.01 1.73 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.52 148.84 1.55 Allowed Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.312 -1.111 . . . . 0.0 108.937 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.57 63.7 2.96 Favored 'Trans proline' 0 C--N 1.303 -1.816 0 O-C-N 123.638 1.336 . . . . 0.0 110.24 -179.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.38 122.26 13.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.415 -0.803 . . . . 0.0 110.17 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD21 ' HB3' ' B' ' 8' ' ' LEU . 1.0 OUTLIER -80.8 -37.66 29.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.322 -0.861 . . . . 0.0 110.208 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 77.3 p -61.49 -20.99 63.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.421 -0.799 . . . . 0.0 110.422 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 3.0 t -86.45 -31.04 21.59 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.223 -0.923 . . . . 0.0 110.077 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 10.0 mtm -76.59 121.33 23.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.439 -0.788 . . . . 0.0 109.996 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 77.2 p -79.74 -165.02 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.35 -0.844 . . . . 0.0 110.589 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.514 ' O ' ' HB ' ' A' ' 93' ' ' ILE . 7.3 pt-20 -66.02 -31.71 72.76 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.5 -0.75 . . . . 0.0 109.301 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.515 ' HA ' ' HB ' ' A' ' 93' ' ' ILE . 9.2 mt-10 -85.35 -40.56 16.38 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -63.83 -44.91 91.81 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.626 ' HB3' HG13 ' B' ' 70' ' ' VAL . 63.6 mt-30 -67.17 -33.53 75.59 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 90' ' ' GLU . 0.1 OUTLIER -60.88 -39.87 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.175 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.35 -33.21 69.3 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.411 ' CD2' HD13 ' B' ' 8' ' ' LEU . 28.5 t80 -64.75 -39.06 92.99 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.43 0.633 . . . . 0.0 109.478 179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.716 ' C ' HG21 ' B' ' 44' ' ' ILE . . . -78.76 -35.01 45.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.641 -0.662 . . . . 0.0 110.297 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.495 ' HA ' ' HA2' ' B' ' 47' ' ' GLY . 2.0 mtt -79.18 -26.65 42.65 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.218 -0.926 . . . . 0.0 109.597 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.8 tp60 -87.65 -23.0 24.38 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.539 -0.725 . . . . 0.0 110.284 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 1.3 tpp -96.09 -19.83 19.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.289 -0.882 . . . . 0.0 110.617 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 40.2 m -95.52 -32.79 12.69 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.181 -0.949 . . . . 0.0 110.519 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.53 HD23 ' N ' ' A' ' 102' ' ' GLN . 0.2 OUTLIER -59.57 -27.64 66.42 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.316 -0.865 . . . . 0.0 109.954 179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . 0.53 ' N ' HD23 ' A' ' 101' ' ' LEU . 75.5 mm-40 -74.79 -37.68 62.33 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.293 -0.88 . . . . 0.0 110.356 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 80.09 112.74 0.27 Allowed Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -111.22 81.33 1.42 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.372 -1.076 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -94.03 -55.82 3.08 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.416 -0.803 . . . . 0.0 110.083 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -110.53 49.09 0.87 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 110.05 179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -62.3 91.76 0.07 OUTLIER Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.22 66.24 0.69 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.437 -1.037 . . . . 0.0 110.107 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . 52.2 67.57 0.95 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.285 -0.884 . . . . 0.0 110.34 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -114.81 -52.35 2.7 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.273 -0.892 . . . . 0.0 110.215 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 45.9 p -148.69 130.29 14.94 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.198 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.249 179.95 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.598 ' SD ' HG23 ' B' ' 17' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.422 0.629 . . . . 0.0 110.633 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.6 145.69 25.55 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.546 -0.721 . . . . 0.0 109.795 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . . . . . . . . . 10.4 pt -137.59 158.5 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.313 -0.867 . . . . 0.0 110.386 179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -111.79 142.68 43.84 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.679 -0.638 . . . . 0.0 110.648 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' B' ' 12' ' ' THR . 95.0 t -128.03 122.85 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.444 -0.785 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.426 ' HG2' HG23 ' B' ' 12' ' ' THR . 1.8 mtmm -99.59 128.92 45.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.413 -0.804 . . . . 0.0 110.148 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 52.3 p -95.5 178.17 5.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.399 -0.813 . . . . 0.0 110.666 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LEU . . . . . 0.645 ' HB3' HD21 ' A' ' 84' ' ' LEU . 4.5 mm? -61.47 -14.99 33.33 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.579 -0.701 . . . . 0.0 111.048 -179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' THR . . . . . . . . . . . . . 67.7 p -95.56 16.99 15.65 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.16 -0.962 . . . . 0.0 110.715 -179.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 68.12 9.63 57.57 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' B' ' 6' ' ' LYS . 4.2 tttt -85.06 135.9 33.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.039 -1.271 . . . . 0.0 109.828 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.426 HG23 ' HG2' ' B' ' 6' ' ' LYS . 13.8 m -113.49 126.49 55.37 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.407 -0.808 . . . . 0.0 110.306 -179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 20.7 mt -109.0 139.47 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.322 -0.861 . . . . 0.0 110.115 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 63.2 m -101.89 121.85 42.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.373 -0.83 . . . . 0.0 109.564 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.601 HD23 ' HE3' ' B' ' 33' ' ' LYS . 16.4 mt -123.5 161.02 25.71 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.286 -0.884 . . . . 0.0 110.609 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -105.73 113.62 27.29 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.373 -0.829 . . . . 0.0 109.515 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.598 HG23 ' SD ' ' B' ' 1' ' ' MET . 17.5 m -140.36 172.85 11.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.399 -0.813 . . . . 0.0 110.972 -179.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' B' ' 56' ' ' LEU . 1.3 mt-10 -112.93 163.46 17.92 Favored Pre-proline 0 N--CA 1.489 1.476 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -71.04 -26.18 21.89 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 123.448 1.236 . . . . 0.0 110.34 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.9 p -84.67 -3.05 58.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.221 -0.925 . . . . 0.0 110.436 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -71.2 144.1 50.25 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.133 -0.98 . . . . 0.0 110.397 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 55' ' ' THR . 45.2 p -83.26 159.51 21.93 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.581 -0.699 . . . . 0.0 110.535 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . 0.567 HG23 HD12 ' B' ' 43' ' ' LEU . 46.7 mm -59.88 -37.29 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.614 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -59.61 -36.01 75.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.327 -0.858 . . . . 0.0 109.519 179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.42 -33.55 71.48 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.506 -0.746 . . . . 0.0 109.541 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . 59.2 t -70.08 -40.18 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.383 -0.823 . . . . 0.0 109.288 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LYS . . . . . 0.484 ' HE2' HG22 ' B' ' 23' ' ' ILE . 15.1 mttt -62.86 -43.12 99.65 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.459 -0.776 . . . . 0.0 109.228 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.41 -32.18 72.12 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.476 -0.765 . . . . 0.0 109.334 178.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.544 ' HD3' HG12 ' B' ' 17' ' ' VAL . 3.9 mttt -68.2 -41.48 81.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.529 -0.732 . . . . 0.0 109.608 179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.568 HG12 HD11 ' B' ' 15' ' ' LEU . 20.3 mt -67.02 -36.98 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.326 -0.858 . . . . 0.0 109.103 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -50.77 72.22 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.421 -0.8 . . . . 0.0 109.371 179.025 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -58.31 -25.78 62.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.483 -0.761 . . . . 0.0 110.391 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LYS . . . . . 0.601 ' HE3' HD23 ' B' ' 15' ' ' LEU . 4.0 mmtm -84.02 -41.76 16.9 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.304 -0.872 . . . . 0.0 110.964 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -107.79 -53.09 2.67 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.28 -0.888 . . . . 0.0 110.569 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLY . . . . . . . . . . . . . . . 127.48 16.66 2.26 Favored Glycine 0 N--CA 1.492 2.417 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' ILE . . . . . 0.479 HG23 ' HD2' ' B' ' 37' ' ' PRO . 69.2 mt -91.2 143.28 28.13 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.113 -1.227 . . . . 0.0 109.788 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.537 ' HG2' ' HB2' ' B' ' 40' ' ' GLN . 40.0 Cg_endo -68.97 136.13 34.26 Favored 'Trans proline' 0 C--N 1.31 -1.493 0 O-C-N 123.651 1.343 . . . . 0.0 110.497 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.73 -26.7 83.5 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.78 1.411 . . . . 0.0 111.144 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -68.61 -22.23 64.45 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.34 -0.85 . . . . 0.0 109.836 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' GLN . . . . . 0.537 ' HB2' ' HG2' ' B' ' 37' ' ' PRO . 20.8 mp0 -101.07 -0.44 36.31 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.401 -0.812 . . . . 0.0 110.52 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -94.19 139.25 31.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.079 -1.013 . . . . 0.0 110.374 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.485 ' CD ' HD11 ' A' ' 93' ' ' ILE . 0.0 OUTLIER -130.3 129.21 42.94 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.413 -0.804 . . . . 0.0 109.953 179.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' LEU . . . . . 0.8 ' C ' HD12 ' B' ' 44' ' ' ILE . 15.8 mt -104.71 123.97 48.56 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.302 -0.874 . . . . 0.0 110.563 -179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . 0.8 HD12 ' C ' ' B' ' 43' ' ' LEU . 1.9 mp -121.43 136.77 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.55 -0.719 . . . . 0.0 109.788 179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' PHE . . . . . 0.552 ' HB2' HD23 ' B' ' 67' ' ' LEU . 56.0 t80 -141.34 139.98 33.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.447 -0.783 . . . . 0.0 110.187 179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . 45.07 31.66 0.76 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.501 -0.75 . . . . 0.0 111.753 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' GLY . . . . . 0.495 ' HA2' ' HA ' ' A' ' 97' ' ' MET . . . 80.96 2.18 90.25 Favored Glycine 0 N--CA 1.494 2.532 0 C-N-CA 120.041 -1.076 . . . . 0.0 110.663 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 mttp -110.84 128.78 55.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.092 -1.24 . . . . 0.0 110.447 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -77.94 136.06 37.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.201 -0.937 . . . . 0.0 109.259 179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.677 HD22 ' CG ' ' B' ' 59' ' ' TYR . 20.3 mt -83.89 137.97 33.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.34 -0.85 . . . . 0.0 110.553 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -93.59 133.38 36.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.383 -0.823 . . . . 0.0 110.467 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.495 ' HA ' ' HB ' ' B' ' 23' ' ' ILE . 71.0 m-20 -48.29 -28.8 3.32 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.483 -0.76 . . . . 0.0 111.233 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.02 -8.45 85.71 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 120.188 -1.006 . . . . 0.0 110.7 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ARG . . . . . . . . . . . . . 3.1 mmt180 -99.45 157.0 16.73 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.028 -1.278 . . . . 0.0 110.597 -179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' THR . . . . . 0.54 ' HA ' ' HA ' ' B' ' 22' ' ' THR . 54.3 p -102.33 163.7 12.09 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.831 . . . . 0.0 110.281 179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 61' ' ' ILE . 89.9 mt -53.56 -43.41 68.44 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.378 -0.826 . . . . 0.0 111.014 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' SER . . . . . . . . . . . . . 21.1 t -56.78 -31.79 64.99 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.305 -0.872 . . . . 0.0 111.193 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -59.68 -31.17 69.32 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.218 -0.926 . . . . 0.0 110.565 -179.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' TYR . . . . . 0.677 ' CG ' HD22 ' B' ' 50' ' ' LEU . 93.3 m-85 -101.27 29.25 4.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.378 -0.826 . . . . 0.0 109.964 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 50.81 30.1 4.84 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.621 -0.675 . . . . 0.0 110.876 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ILE . . . . . 0.599 HD13 HD21 ' B' ' 67' ' ' LEU . 86.8 mt -81.43 108.11 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.318 -0.864 . . . . 0.0 109.629 179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.59 177.71 4.77 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.25 -0.906 . . . . 0.0 110.595 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' B' ' 64' ' ' GLU . 3.6 ptpp? -46.5 149.63 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.597 -0.689 . . . . 0.0 111.091 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' B' ' 63' ' ' LYS . 1.7 mm-40 62.89 17.55 10.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.759 -0.588 . . . . 0.0 110.652 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' SER . . . . . 0.412 ' HB3' HG23 ' B' ' 61' ' ' ILE . 0.5 OUTLIER -71.38 139.71 49.89 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.265 -0.897 . . . . 0.0 109.998 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' THR . . . . . . . . . . . . . 90.2 m -107.25 108.77 20.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.299 -0.875 . . . . 0.0 110.097 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.599 HD21 HD13 ' B' ' 61' ' ' ILE . 2.0 mt -102.47 163.22 12.35 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.399 -0.813 . . . . 0.0 109.846 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 33.1 m80 -108.58 134.68 51.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.19 -0.944 . . . . 0.0 109.825 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' B' ' 42' ' ' ARG . 27.2 tp -107.03 134.74 49.72 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.163 -0.96 . . . . 0.0 110.629 -179.498 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 92' ' ' GLN . 31.8 t -124.77 152.47 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.443 -0.786 . . . . 0.0 109.68 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mt -93.94 124.84 38.21 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.35 -0.844 . . . . 0.0 110.282 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.435 ' HA ' ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -76.01 73.13 2.89 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.42 -0.8 . . . . 0.0 110.157 179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -104.11 110.07 22.11 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.355 -0.841 . . . . 0.0 110.274 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -75.09 178.44 5.68 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.403 -0.811 . . . . 0.0 110.141 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 159.69 -130.42 2.44 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.366 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 -179.901 . . . . . . . . 0 0 . 1 stop_ save_