data_2xk0_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 2xk0 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.533 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t . . . . . 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.418 ' HA ' ' O ' ' A' ' 40' ' ' GLY . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.446 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.442 ' C ' HD13 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.563 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' ASP . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.514 HG12 ' CD1' ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.522 HD11 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.533 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.522 ' HB2' HD11 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.561 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.527 ' HA ' HD13 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.403 -2.811 0 CA-C-O 121.028 0.442 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.434 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.466 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.437 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.482 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.516 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.586 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' A' ' 58' ' ' SER . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.491 ' CG ' ' HG ' ' A' ' 58' ' ' SER . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.502 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.454 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.437 ' CZ3' HG22 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.49 ' HA ' HD13 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt . . . . . 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.425 -1.676 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.51 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.464 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.419 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.51 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.533 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.622 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.408 ' HB2' HD12 ' A' ' 67' ' ' LEU . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.493 ' HB2' HD11 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.572 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.489 ' HA ' HD13 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 24.7 mt . . . . . 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.2 t . . . . . 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.471 ' C ' HD13 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.471 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.485 HG12 ' CD1' ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.573 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.553 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.442 ' HB2' HD12 ' A' ' 67' ' ' LEU . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.573 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HB2' HD11 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.482 ' O ' HD13 ' A' ' 67' ' ' LEU . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 63' ' ' GLU . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.529 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.498 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.535 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.499 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.535 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HB2' HD13 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' HD13 ' A' ' 67' ' ' LEU . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' HD13 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 63' ' ' GLU . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.529 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt . . . . . 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.559 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t . . . . . 0 N--CA 1.414 -2.243 0 CA-C-O 120.788 0.328 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.531 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.405 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.531 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.488 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.623 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.587 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.559 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.623 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' A' ' 58' ' ' SER . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.503 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.549 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.43 ' O ' HD13 ' A' ' 67' ' ' LEU . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.587 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt . . . . . 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.575 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.439 ' HG3' HG12 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.439 HG12 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.62 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.608 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.62 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.528 ' CD1' ' HB3' ' A' ' 22' ' ' TYR . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 61' ' ' TRP . 24.1 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.476 ' HB2' HD12 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.6 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.577 ' HA ' ' O ' ' A' ' 58' ' ' SER . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.577 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.477 ' HA ' HD13 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt . . . . . 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.424 -1.751 0 CA-C-O 121.217 0.532 . . . . 0.0 111.537 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.449 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.495 HG12 ' CD1' ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.493 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.638 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' HD12 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.493 ' HB2' HD13 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.432 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.521 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.638 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.526 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.412 -2.373 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.585 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.585 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.469 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.484 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.404 ' HB2' HD12 ' A' ' 67' ' ' LEU . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.479 ' HG ' HD12 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.545 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.484 ' HB2' HD13 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.438 ' O ' HD13 ' A' ' 67' ' ' LEU . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.48 ' HA ' HD13 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.48 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.427 -1.58 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.541 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.463 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.497 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.483 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.443 ' HB2' HD12 ' A' ' 67' ' ' LEU . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD12 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.483 ' HB2' HD13 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.525 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.467 ' O ' HD13 ' A' ' 67' ' ' LEU . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HA ' HD13 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.567 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.02 120.81 41.1 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 50.6 ttm 74.4 -44.26 0.55 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.147 1.379 . . . . 0.0 112.543 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -119.36 86.71 34.09 Favored Pre-proline 0 C--N 1.303 -1.433 0 O-C-N 122.303 -0.248 . . . . 0.0 110.336 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.504 ' CD ' ' HD2' ' A' ' 18' ' ' PRO . 6.5 Cg_exo -78.53 150.5 24.89 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 122.093 1.862 . . . . 0.0 110.096 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -68.58 102.43 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.512 2.141 . . . . 0.0 112.698 -177.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.2 m -141.5 -175.79 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 C-N-CA 123.279 0.632 . . . . 0.0 110.47 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.22 30.4 4.18 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.923 0.868 . . . . 0.0 109.744 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.29 166.35 20.57 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.439 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 37.4 Cg_exo -64.2 -168.97 0.1 Allowed 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.978 2.452 . . . . 0.0 112.734 178.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.6 m -71.45 108.55 4.04 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.663 0.385 . . . . 0.0 110.987 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.504 ' HD2' ' CD ' ' A' ' 11' ' ' PRO . 36.9 Cg_exo -66.6 138.41 49.6 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.845 3.03 . . . . 0.0 113.369 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.63 83.69 1.98 Allowed 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -125.53 151.16 31.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.022 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.533 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t -127.72 156.18 42.82 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.418 ' HA ' ' O ' ' A' ' 40' ' ' GLY . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.446 ' O ' HD13 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.442 ' C ' HD13 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.563 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.524 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 27' ' ' ASP . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.514 HG12 ' CD1' ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.522 HD11 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.533 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.518 ' O ' HD12 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.522 ' HB2' HD11 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.561 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.527 ' HA ' HD13 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.527 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.518 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt -82.61 -32.25 28.45 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -129.73 54.59 0.78 Allowed Glycine 0 CA--C 1.499 -0.964 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.226 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.42 -67.26 3.12 Favored Glycine 0 C--N 1.319 -0.397 0 C-N-CA 121.577 -0.344 . . . . 0.0 112.549 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.22 133.77 4.96 Favored Glycine 0 N--CA 1.434 -1.433 0 C-N-CA 121.745 -0.264 . . . . 0.0 112.49 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.1 m -97.11 -0.38 47.14 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.476 1.132 . . . . 0.0 109.205 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.418 -2.06 0 N-CA-C 104.389 -2.449 . . . . 0.0 104.389 179.167 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.499 ' O ' ' HG2' ' A' ' 63' ' ' GLU . . . . . . . . 0 CA--C 1.494 -1.252 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -178.81 138.28 0.16 Allowed 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 123.939 0.896 . . . . 0.0 109.638 176.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 55.9 mtt -86.29 75.5 9.83 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.9 161.31 9.69 Favored Pre-proline 0 C--N 1.304 -1.393 0 CA-C-N 114.086 -1.416 . . . . 0.0 107.363 -177.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.613 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -67.01 178.64 2.77 Favored 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 122.458 2.105 . . . . 0.0 110.152 170.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -45.99 128.03 11.07 Favored 'Trans proline' 0 C--N 1.371 1.716 0 C-N-CA 122.889 2.392 . . . . 0.0 112.75 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.6 m -79.06 153.52 4.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.959 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.869 -178.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 63.24 27.17 15.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.075 0.95 . . . . 0.0 111.241 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 17' ' ' SER . . . -122.51 169.88 8.94 Favored Pre-proline 0 C--N 1.296 -1.722 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.19 19.35 0.37 Allowed 'Trans proline' 0 CA--C 1.551 1.344 0 C-N-CA 122.021 1.814 . . . . 0.0 113.178 178.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.461 ' H ' ' C ' ' A' ' 15' ' ' ALA . 20.4 m -100.17 147.18 33.16 Favored Pre-proline 0 C--N 1.292 -1.933 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.613 ' O ' ' HD2' ' A' ' 11' ' ' PRO . 34.4 Cg_exo -61.49 137.44 69.64 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.156 1.904 . . . . 0.0 113.85 -175.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -174.39 134.02 0.4 Allowed 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.9 m -81.13 154.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-O 121.358 0.599 . . . . 0.0 111.102 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p -130.81 150.52 51.94 Favored 'General case' 0 N--CA 1.403 -2.811 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.063 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.434 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.466 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.482 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.437 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.437 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.482 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.516 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.586 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.437 HG22 ' CZ3' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.516 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.502 ' HA ' ' O ' ' A' ' 58' ' ' SER . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.491 ' CG ' ' HG ' ' A' ' 58' ' ' SER . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.502 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.454 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.437 ' CZ3' HG22 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.49 ' HA ' HD13 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.413 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt -79.49 -33.59 42.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -168.7 53.43 0.21 Allowed Glycine 0 CA--C 1.494 -1.276 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.543 ' O ' ' HG2' ' A' ' 69' ' ' LYS . . . -163.25 53.77 0.29 Allowed Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.709 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -46.51 -50.77 13.35 Favored Glycine 0 C--N 1.344 1.013 0 O-C-N 124.289 0.64 . . . . 0.0 112.424 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.6 m -128.91 -64.33 0.92 Allowed 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 175.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.499 -0.983 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 176.033 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.15 97.18 0.04 OUTLIER 'General case' 0 C--O 1.248 1.01 0 C-N-CA 124.801 1.24 . . . . 0.0 111.911 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 26.4 mmt -78.71 107.93 11.76 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.523 0.678 . . . . 0.0 109.95 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.37 146.69 40.13 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.11 140.42 49.49 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 121.874 1.716 . . . . 0.0 111.176 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.85 50.67 1.46 Allowed 'Trans proline' 0 CA--C 1.554 1.517 0 C-N-CA 123.368 2.712 . . . . 0.0 112.401 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.7 t 69.47 -68.28 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.554 1.541 . . . . 0.0 111.548 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.12 88.3 6.46 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 121.201 0.525 . . . . 0.0 109.794 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.5 167.18 11.67 Favored Pre-proline 0 C--N 1.309 -1.19 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.591 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -73.63 -157.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 122.299 1.999 . . . . 0.0 110.886 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -69.07 147.73 97.66 Favored Pre-proline 0 C--N 1.308 -1.227 0 O-C-N 122.172 -0.33 . . . . 0.0 110.418 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -62.35 137.78 67.42 Favored 'Trans proline' 0 C--O 1.25 1.077 0 C-N-CA 121.766 1.644 . . . . 0.0 111.163 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.67 79.35 0.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.969 1.308 . . . . 0.0 112.245 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.5 m -77.17 145.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.173 176.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t -122.43 162.25 22.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.421 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.407 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.51 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.464 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.419 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.649 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.649 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.51 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.533 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.622 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.408 ' HB2' HD12 ' A' ' 67' ' ' LEU . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.622 ' O ' HD12 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.493 ' HB2' HD11 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.572 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.489 ' HA ' HD13 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 24.7 mt -80.53 -24.07 39.58 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.442 ' HA2' ' O ' ' A' ' 75' ' ' SER . . . -92.32 -79.8 1.42 Allowed Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.565 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -161.89 -8.5 0.04 OUTLIER Glycine 0 CA--C 1.529 0.935 0 C-N-CA 120.149 -1.024 . . . . 0.0 115.054 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 145.22 -70.89 0.37 Allowed Glycine 0 CA--C 1.497 -1.082 0 C-N-CA 119.032 -1.556 . . . . 0.0 112.095 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.6 m -67.24 -31.45 71.8 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.442 ' O ' ' HA2' ' A' ' 71' ' ' GLY . 10.5 t . . . . . 0 N--CA 1.407 -2.625 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 173.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.217 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.01 -38.68 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.956 0.378 . . . . 0.0 110.299 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ttt 70.65 28.75 3.44 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 122.296 1.046 . . . . 0.0 108.702 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.43 108.76 21.33 Favored Pre-proline 0 C--O 1.248 1.0 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.755 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -75.18 134.73 17.87 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.6 2.2 . . . . 0.0 112.334 -177.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -55.29 -44.14 51.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.14 2.56 . . . . 0.0 111.097 173.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.3 t -89.29 101.18 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.12 62.14 6.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 122.125 0.964 . . . . 0.0 111.388 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.09 -51.86 0.22 Allowed Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.293 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -87.54 159.21 7.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 121.436 1.424 . . . . 0.0 109.09 169.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.2 m -89.77 138.16 28.11 Favored Pre-proline 0 C--N 1.29 -2.003 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.12 136.26 43.63 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 N-CA-C 106.87 -2.012 . . . . 0.0 106.87 171.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 55.2 79.61 0.15 Allowed 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.572 0.701 . . . . 0.0 110.146 -173.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.0 m -66.04 139.21 21.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.508 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.2 t -130.22 158.17 40.48 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.471 ' C ' HD13 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.471 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.485 HG12 ' CD1' ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.573 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.553 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.442 ' HB2' HD12 ' A' ' 67' ' ' LEU . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.573 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.527 ' HB2' HD11 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.529 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.482 ' O ' HD13 ' A' ' 67' ' ' LEU . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.553 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.569 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 63' ' ' GLU . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt -85.11 -29.15 25.07 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -76.18 70.72 2.08 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.48 -0.782 . . . . 0.0 114.018 -176.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.34 -64.62 2.45 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 114.487 0.555 . . . . 0.0 114.487 175.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -67.2 113.81 5.86 Favored Glycine 0 N--CA 1.433 -1.502 0 O-C-N 123.781 0.342 . . . . 0.0 113.88 -173.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 m -83.29 1.65 39.93 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 109.324 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.427 -1.595 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.418 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.578 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.12 154.21 24.45 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.3 mtt 73.65 152.65 0.13 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.041 1.337 . . . . 0.0 112.147 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.05 110.96 62.64 Favored Pre-proline 0 C--N 1.304 -1.387 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -62.82 116.92 3.85 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.237 2.624 . . . . 0.0 112.519 -178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -75.18 112.0 3.45 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.213 1.942 . . . . 0.0 110.037 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t 72.58 156.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 O-C-N 123.737 0.648 . . . . 0.0 110.264 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.5 -171.65 0.1 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 125.141 1.377 . . . . 0.0 109.732 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.443 ' C ' ' H ' ' A' ' 17' ' ' SER . . . -57.34 132.3 81.27 Favored Pre-proline 0 C--N 1.318 -0.771 0 O-C-N 123.241 0.338 . . . . 0.0 110.573 179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.36 19.95 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.237 2.624 . . . . 0.0 113.31 -177.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 15' ' ' ALA . 19.8 m -100.46 108.14 51.63 Favored Pre-proline 0 C--N 1.284 -2.268 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -67.33 137.09 42.32 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 121.382 1.388 . . . . 0.0 111.384 -176.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -157.06 -174.16 4.79 Favored 'General case' 0 N--CA 1.398 -3.044 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.447 HG21 ' CE2' ' A' ' 22' ' ' TYR . 4.5 m -131.65 174.57 12.93 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 C-N-CA 123.825 0.85 . . . . 0.0 110.038 -178.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p -119.19 159.89 23.18 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 123.641 0.588 . . . . 0.0 109.514 174.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.529 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.498 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.498 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.535 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.499 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HG ' HD12 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.535 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.499 ' HB2' HD13 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.524 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' O ' HD13 ' A' ' 67' ' ' LEU . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.46 ' HA ' HD13 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.461 HD13 ' O ' ' A' ' 63' ' ' GLU . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.529 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt -71.43 -32.23 68.14 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -159.81 156.86 28.08 Favored Glycine 0 N--CA 1.414 -2.807 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.72 49.57 6.48 Favored Glycine 0 C--N 1.304 -1.21 0 C-N-CA 120.396 -0.907 . . . . 0.0 110.848 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.96 95.04 0.26 Allowed Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.0 m -52.39 125.72 17.01 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.165 1.386 . . . . 0.0 113.155 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.3 -1.56 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.339 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.732 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -131.06 23.23 4.9 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.7 tpp 74.93 -53.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.378 1.471 . . . . 0.0 110.224 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -126.21 144.2 48.29 Favored Pre-proline 0 C--N 1.303 -1.455 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.73 143.41 95.33 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.699 2.266 . . . . 0.0 113.085 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.54 150.38 69.34 Favored 'Trans proline' 0 C--O 1.247 0.926 0 C-N-CA 123.153 2.569 . . . . 0.0 111.952 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.9 t -83.89 72.5 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.519 0.675 . . . . 0.0 110.325 -177.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 174.49 32.92 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 125.989 1.715 . . . . 0.0 107.161 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.35 161.51 41.22 Favored Pre-proline 0 C--N 1.3 -1.554 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.397 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -77.13 -142.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.167 0 C-N-CA 122.916 2.411 . . . . 0.0 109.773 173.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -67.97 157.84 85.59 Favored Pre-proline 0 C--N 1.301 -1.523 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.72 138.74 86.45 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.495 2.13 . . . . 0.0 112.028 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -126.26 90.9 3.26 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.466 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.508 HG12 ' HZ2' ' A' ' 69' ' ' LYS . 9.3 t -104.53 154.73 6.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.559 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t -129.34 166.28 19.82 Favored 'General case' 0 N--CA 1.414 -2.243 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.601 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.493 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.531 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.405 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.464 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.531 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.488 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.623 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.587 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.559 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.623 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' A' ' 58' ' ' SER . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.503 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.549 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.43 ' O ' HD13 ' A' ' 67' ' ' LEU . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.587 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.501 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.508 ' HZ2' HG12 ' A' ' 20' ' ' VAL . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt -73.67 -32.56 64.04 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -122.3 119.82 4.11 Favored Glycine 0 N--CA 1.418 -2.524 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.05 38.22 27.0 Favored Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.87 90.38 0.87 Allowed Glycine 0 N--CA 1.426 -1.969 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.254 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.2 m -80.02 -39.38 30.02 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.426 -1.648 0 N-CA-C 104.997 -2.223 . . . . 0.0 104.997 177.508 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.876 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.43 77.23 9.5 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 45.8 tpp 166.92 103.7 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 127.172 2.189 . . . . 0.0 106.489 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -150.73 140.42 13.82 Favored Pre-proline 0 C--N 1.296 -1.755 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.403 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 8.8 Cg_endo -53.43 121.98 10.44 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.614 2.209 . . . . 0.0 110.301 174.208 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 11.8 Cg_exo -71.71 44.81 0.65 Allowed 'Trans proline' 0 N--CA 1.488 1.155 0 C-N-CA 123.728 2.952 . . . . 0.0 113.656 -177.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 p -155.31 139.12 8.31 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.22 70.28 10.09 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 122.007 0.908 . . . . 0.0 110.539 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB2' ' HD3' ' A' ' 16' ' ' PRO . . . -130.85 -54.6 0.03 OUTLIER Pre-proline 0 C--N 1.297 -1.681 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.479 178.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.491 ' HD3' ' HB2' ' A' ' 15' ' ' ALA . 62.3 Cg_endo -93.93 168.59 2.01 Favored 'Trans proline' 0 N--CA 1.441 -1.576 0 C-N-CA 121.549 1.5 . . . . 0.0 109.883 173.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 t -97.35 114.15 64.37 Favored Pre-proline 0 C--N 1.291 -1.954 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -68.33 136.54 37.35 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 121.05 1.167 . . . . 0.0 110.161 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 173.88 140.68 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 C-N-CA 124.088 0.955 . . . . 0.0 108.552 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.59 131.44 71.35 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 172.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t -125.2 153.11 43.61 Favored 'General case' 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.575 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.439 ' HG3' HG12 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.439 HG12 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.62 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.486 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.608 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.62 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.528 ' CD1' ' HB3' ' A' ' 22' ' ' TYR . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.6 HD12 ' O ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' NE2' ' HB3' ' A' ' 61' ' ' TRP . 24.1 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.476 ' HB2' HD12 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.6 ' O ' HD12 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.577 ' HA ' ' O ' ' A' ' 58' ' ' SER . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.577 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.52 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.414 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.477 ' HA ' HD13 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.575 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.441 HD21 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt -83.23 -33.41 26.1 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -119.14 48.6 0.93 Allowed Glycine 0 N--CA 1.438 -1.195 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.078 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.24 -69.44 3.27 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -127.53 -167.82 12.37 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.2 m -119.81 139.22 52.68 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.341 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.887 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 45.9 85.13 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.456 1.102 . . . . 0.0 112.393 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ptm -76.55 140.51 41.13 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -122.12 104.03 38.66 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.93 111.91 3.18 Favored 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.208 1.939 . . . . 0.0 112.519 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -64.86 -48.0 4.39 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.409 2.073 . . . . 0.0 110.798 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.8 m -126.97 111.6 26.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.041 176.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.75 177.76 3.27 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.6 -52.66 63.47 Favored Pre-proline 0 C--N 1.313 -1.009 0 O-C-N 123.335 0.397 . . . . 0.0 111.787 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -89.29 159.43 5.6 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.173 1.249 . . . . 0.0 111.218 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -115.18 160.81 32.6 Favored Pre-proline 0 C--N 1.291 -1.938 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.26 138.6 67.36 Favored 'Trans proline' 0 C--O 1.242 0.697 0 C-N-CA 121.446 1.431 . . . . 0.0 110.286 175.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 58.35 83.86 0.11 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.136 0.974 . . . . 0.0 111.779 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.552 HG22 ' CE1' ' A' ' 22' ' ' TYR . 10.5 m -85.41 166.17 2.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.949 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p -104.25 155.55 18.65 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.537 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.552 ' CE1' HG22 ' A' ' 20' ' ' VAL . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.427 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.449 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.485 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.476 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.495 HG12 ' CD1' ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.493 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.638 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.491 ' HG ' HD12 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.493 ' HB2' HD13 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.432 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.521 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.638 ' HD3' ' O ' ' A' ' 48' ' ' ASP . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.485 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.526 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.526 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt -80.9 -33.41 34.25 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -144.47 149.76 21.84 Favored Glycine 0 N--CA 1.424 -2.164 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.86 -100.14 2.65 Favored Glycine 0 N--CA 1.425 -2.061 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 117.06 -55.74 0.55 Allowed Glycine 0 CA--C 1.49 -1.495 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.0 m -76.14 -21.39 56.64 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 174.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 N--CA 1.42 -1.934 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 175.827 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.45 90.23 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.529 1.132 . . . . 0.0 111.576 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 13.7 tpt 65.94 25.21 11.11 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 122.663 1.22 . . . . 0.0 109.593 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -132.93 122.67 17.67 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.214 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -58.74 120.54 8.48 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.303 2.668 . . . . 0.0 113.943 -175.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -64.4 -46.23 7.88 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.683 2.255 . . . . 0.0 110.409 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.9 t -101.37 152.5 5.19 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.4 119.62 3.13 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 124.076 0.95 . . . . 0.0 111.998 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB2' ' HD2' ' A' ' 16' ' ' PRO . . . -146.29 174.52 3.35 Favored Pre-proline 0 C--N 1.305 -1.332 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 -176.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.407 ' HD2' ' HB2' ' A' ' 15' ' ' ALA . 11.2 Cg_endo -55.92 -179.42 0.08 OUTLIER 'Trans proline' 0 CA--C 1.551 1.369 0 C-N-CA 123.097 2.531 . . . . 0.0 112.736 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 t -77.02 125.82 86.32 Favored Pre-proline 0 C--N 1.302 -1.475 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -178.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.06 137.92 50.21 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.051 1.834 . . . . 0.0 110.529 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -109.73 88.61 2.79 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-O 121.501 0.667 . . . . 0.0 111.83 -175.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -89.09 157.97 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.502 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.584 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p -126.02 155.93 40.69 Favored 'General case' 0 C--N 1.278 -2.541 0 O-C-N 123.247 0.342 . . . . 0.0 111.796 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.585 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.51 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.585 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.469 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.484 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.404 ' HB2' HD12 ' A' ' 67' ' ' LEU . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.479 ' HG ' HD12 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.545 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.484 ' HB2' HD13 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.419 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.545 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.438 ' O ' HD13 ' A' ' 67' ' ' LEU . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.48 ' HA ' HD13 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.48 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -72.42 -34.38 67.79 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -110.85 25.19 15.03 Favored Glycine 0 CA--C 1.489 -1.558 0 C-N-CA 120.509 -0.853 . . . . 0.0 111.889 -176.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.63 -60.81 4.55 Favored Glycine 0 C--N 1.313 -0.706 0 C-N-CA 121.377 -0.44 . . . . 0.0 112.034 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -129.64 130.42 6.32 Favored Glycine 0 N--CA 1.427 -1.917 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 p -164.43 44.81 0.1 Allowed 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.435 -1.214 0 CA-C-N 113.476 -1.693 . . . . 0.0 107.751 -169.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.81 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 65.77 151.28 0.05 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 112.384 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -136.24 168.36 19.56 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.3 150.95 74.05 Favored Pre-proline 0 C--N 1.288 -2.068 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 177.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.6 125.92 17.87 Favored 'Trans proline' 0 C--O 1.244 0.794 0 C-N-CA 122.001 1.801 . . . . 0.0 110.062 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.24 -54.54 5.29 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.197 2.598 . . . . 0.0 111.173 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.445 ' O ' ' HD2' ' A' ' 16' ' ' PRO . 59.3 t -103.16 130.65 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 172.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.21 84.78 4.41 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.684 0.754 . . . . 0.0 111.337 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.472 ' H ' ' HD2' ' A' ' 16' ' ' PRO . . . -150.0 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.923 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.472 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 32.5 Cg_endo -64.37 166.37 17.4 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.185 1.923 . . . . 0.0 110.809 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.6 m -87.42 133.95 37.25 Favored Pre-proline 0 C--N 1.292 -1.918 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 -177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -63.64 148.81 92.06 Favored 'Trans proline' 0 C--O 1.256 1.39 0 C-N-CA 122.819 2.346 . . . . 0.0 110.367 175.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -150.63 -168.67 3.17 Favored 'General case' 0 N--CA 1.41 -2.46 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.7 m -76.01 157.87 5.62 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.181 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.125 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.4 t -138.24 155.12 48.95 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -177.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.541 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.463 HD13 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.541 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.466 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.497 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.483 HD13 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.443 ' HB2' HD12 ' A' ' 67' ' ' LEU . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.446 ' HG ' HD12 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.483 ' HB2' HD13 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.525 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.467 ' O ' HD13 ' A' ' 67' ' ' LEU . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.478 ' HA ' HD13 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt -81.45 -32.78 32.44 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -104.46 -112.95 3.76 Favored Glycine 0 N--CA 1.434 -1.498 0 CA-C-N 115.341 -0.845 . . . . 0.0 112.414 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -72.63 95.23 0.69 Allowed Glycine 0 C--O 1.243 0.672 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.18 34.27 0.1 Allowed Glycine 0 C--N 1.291 -1.923 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.1 t -87.86 109.27 19.64 Favored 'General case' 0 N--CA 1.418 -2.048 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--N 1.287 -2.123 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.276 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.56 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t . . . . . 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.451 ' O ' HD12 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.483 ' C ' HD12 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.559 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.548 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.403 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.548 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.541 HG12 HD12 ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.715 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HG ' HD11 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.715 ' HB2' HD12 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.575 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.746 ' HA ' HD12 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.524 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.403 -2.811 0 CA-C-O 121.028 0.442 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.448 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.485 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.525 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.762 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.45 HG23 ' CH2' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.432 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' HD11 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.525 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 43' ' ' ILE . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.45 ' CH2' HG23 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.672 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt . . . . . 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.425 -1.676 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.441 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.523 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.655 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.655 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.85 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.85 ' HB2' HD12 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.468 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.584 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.662 ' HA ' HD12 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.415 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.7 mt . . . . . 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.422 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 13.2 t . . . . . 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.485 ' C ' HD12 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.543 HG12 HD12 ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.777 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.694 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.582 HD11 HD21 ' A' ' 67' ' ' LEU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.548 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HA ' HD12 ' A' ' 67' ' ' LEU . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.579 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.552 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.499 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA2' ' HE3' ' A' ' 31' ' ' LYS . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.547 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.606 ' HB2' HD12 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.552 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt . . . . . 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.596 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t . . . . . 0 N--CA 1.414 -2.243 0 CA-C-O 120.788 0.328 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.506 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.494 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.554 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.554 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.548 HG12 HD12 ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.852 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.596 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.758 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.567 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.852 ' HB2' HD12 ' A' ' 43' ' ' ILE . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.695 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.695 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt . . . . . 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.581 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.487 HG13 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.521 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.52 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 40' ' ' GLY . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.412 ' N ' HD23 ' A' ' 39' ' ' LEU . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.572 HG12 HD12 ' A' ' 52' ' ' ILE . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.848 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.756 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 67' ' ' LEU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.848 ' HB2' HD12 ' A' ' 43' ' ' ILE . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.708 ' HA ' HD12 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.445 HD22 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt . . . . . 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.424 -1.751 0 CA-C-O 121.217 0.532 . . . . 0.0 111.537 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' ILE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.521 HG12 HD12 ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.746 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.586 ' HG ' HD11 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.565 HD11 HD21 ' A' ' 67' ' ' LEU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.746 ' HB2' HD12 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.706 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.706 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.412 -2.373 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.6 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.496 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.549 HG12 HD12 ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.794 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HB2' HD12 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.427 -1.58 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.436 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG3' HG13 ' A' ' 28' ' ' VAL . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.408 HG11 ' CD1' ' A' ' 22' ' ' TYR . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.557 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.508 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.557 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.504 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.669 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.499 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.669 ' HB2' HD12 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.664 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.567 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.02 120.81 41.1 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 50.6 ttm 74.4 -44.26 0.55 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.147 1.379 . . . . 0.0 112.543 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -119.36 86.71 34.09 Favored Pre-proline 0 C--N 1.303 -1.433 0 O-C-N 122.303 -0.248 . . . . 0.0 110.336 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HD2' ' HD2' ' A' ' 18' ' ' PRO . 6.5 Cg_exo -78.53 150.5 24.89 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 122.093 1.862 . . . . 0.0 110.096 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 14.1 Cg_exo -68.58 102.43 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.512 2.141 . . . . 0.0 112.698 -177.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.2 m -141.5 -175.79 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 C-N-CA 123.279 0.632 . . . . 0.0 110.47 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.22 30.4 4.18 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.923 0.868 . . . . 0.0 109.744 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.29 166.35 20.57 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 37.4 Cg_exo -64.2 -168.97 0.1 Allowed 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.978 2.452 . . . . 0.0 112.734 178.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.6 m -71.45 108.55 4.04 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.663 0.385 . . . . 0.0 110.987 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.563 ' HD2' ' HD2' ' A' ' 11' ' ' PRO . 36.9 Cg_exo -66.6 138.41 49.6 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.845 3.03 . . . . 0.0 113.369 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.63 83.69 1.98 Allowed 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -125.53 151.16 31.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.022 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.56 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t -127.72 156.18 42.82 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.451 ' O ' HD12 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.483 ' C ' HD12 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.559 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.548 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.403 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.548 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.541 HG12 HD12 ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.715 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HG ' HD11 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.715 ' HB2' HD12 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.575 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.746 ' HA ' HD12 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.524 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt -82.61 -32.25 28.45 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -129.73 54.59 0.78 Allowed Glycine 0 CA--C 1.499 -0.964 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.226 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.42 -67.26 3.12 Favored Glycine 0 C--N 1.319 -0.397 0 C-N-CA 121.577 -0.344 . . . . 0.0 112.549 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.22 133.77 4.96 Favored Glycine 0 N--CA 1.434 -1.433 0 C-N-CA 121.745 -0.264 . . . . 0.0 112.49 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.1 m -97.11 -0.38 47.14 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.476 1.132 . . . . 0.0 109.205 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.418 -2.06 0 N-CA-C 104.389 -2.449 . . . . 0.0 104.389 179.167 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.501 ' O ' ' HG2' ' A' ' 63' ' ' GLU . . . . . . . . 0 CA--C 1.494 -1.252 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -178.81 138.28 0.16 Allowed 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 123.939 0.896 . . . . 0.0 109.638 176.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 55.9 mtt -86.29 75.5 9.83 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.9 161.31 9.69 Favored Pre-proline 0 C--N 1.304 -1.393 0 CA-C-N 114.086 -1.416 . . . . 0.0 107.363 -177.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.615 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -67.01 178.64 2.77 Favored 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 122.458 2.105 . . . . 0.0 110.152 170.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -45.99 128.03 11.07 Favored 'Trans proline' 0 C--N 1.371 1.716 0 C-N-CA 122.889 2.392 . . . . 0.0 112.75 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.6 m -79.06 153.52 4.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.959 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.869 -178.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 63.24 27.17 15.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.075 0.95 . . . . 0.0 111.241 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 17' ' ' SER . . . -122.51 169.88 8.94 Favored Pre-proline 0 C--N 1.296 -1.722 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.409 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 60.5 Cg_endo -73.19 19.35 0.37 Allowed 'Trans proline' 0 CA--C 1.551 1.344 0 C-N-CA 122.021 1.814 . . . . 0.0 113.178 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.416 ' H ' ' C ' ' A' ' 15' ' ' ALA . 20.4 m -100.17 147.18 33.16 Favored Pre-proline 0 C--N 1.292 -1.933 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.615 ' O ' ' HD2' ' A' ' 11' ' ' PRO . 34.4 Cg_exo -61.49 137.44 69.64 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.156 1.904 . . . . 0.0 113.85 -175.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -174.39 134.02 0.4 Allowed 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.9 m -81.13 154.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-O 121.358 0.599 . . . . 0.0 111.102 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p -130.81 150.52 51.94 Favored 'General case' 0 N--CA 1.403 -2.811 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.063 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.448 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.485 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.525 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.762 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.45 HG23 ' CH2' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.432 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' HD11 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.525 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 43' ' ' ILE . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.45 ' CH2' HG23 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.672 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt -79.49 -33.59 42.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -168.7 53.43 0.21 Allowed Glycine 0 CA--C 1.494 -1.276 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.539 ' O ' ' HG2' ' A' ' 69' ' ' LYS . . . -163.25 53.77 0.29 Allowed Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.709 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -46.51 -50.77 13.35 Favored Glycine 0 C--N 1.344 1.013 0 O-C-N 124.289 0.64 . . . . 0.0 112.424 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.6 m -128.91 -64.33 0.92 Allowed 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 175.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.499 -0.983 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 176.033 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.15 97.18 0.04 OUTLIER 'General case' 0 C--O 1.248 1.01 0 C-N-CA 124.801 1.24 . . . . 0.0 111.911 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 26.4 mmt -78.71 107.93 11.76 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.523 0.678 . . . . 0.0 109.95 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.37 146.69 40.13 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.11 140.42 49.49 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 121.874 1.716 . . . . 0.0 111.176 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.85 50.67 1.46 Allowed 'Trans proline' 0 CA--C 1.554 1.517 0 C-N-CA 123.368 2.712 . . . . 0.0 112.401 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.7 t 69.47 -68.28 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.554 1.541 . . . . 0.0 111.548 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.12 88.3 6.46 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 121.201 0.525 . . . . 0.0 109.794 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.5 167.18 11.67 Favored Pre-proline 0 C--N 1.309 -1.19 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.591 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -73.63 -157.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 122.299 1.999 . . . . 0.0 110.886 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -69.07 147.73 97.66 Favored Pre-proline 0 C--N 1.308 -1.227 0 O-C-N 122.172 -0.33 . . . . 0.0 110.418 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -62.35 137.78 67.42 Favored 'Trans proline' 0 C--O 1.25 1.077 0 C-N-CA 121.766 1.644 . . . . 0.0 111.163 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.67 79.35 0.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.969 1.308 . . . . 0.0 112.245 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.5 m -77.17 145.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.173 176.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t -122.43 162.25 22.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.441 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.523 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.655 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.655 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.85 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.85 ' HB2' HD12 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.468 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.584 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.662 ' HA ' HD12 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.415 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.7 mt -80.53 -24.07 39.58 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 75' ' ' SER . . . -92.32 -79.8 1.42 Allowed Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.565 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -161.89 -8.5 0.04 OUTLIER Glycine 0 CA--C 1.529 0.935 0 C-N-CA 120.149 -1.024 . . . . 0.0 115.054 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 145.22 -70.89 0.37 Allowed Glycine 0 CA--C 1.497 -1.082 0 C-N-CA 119.032 -1.556 . . . . 0.0 112.095 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.6 m -67.24 -31.45 71.8 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.443 ' O ' ' HA3' ' A' ' 71' ' ' GLY . 10.5 t . . . . . 0 N--CA 1.407 -2.625 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 173.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.217 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.01 -38.68 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.956 0.378 . . . . 0.0 110.299 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ttt 70.65 28.75 3.44 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 122.296 1.046 . . . . 0.0 108.702 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . . . -87.43 108.76 21.33 Favored Pre-proline 0 C--O 1.248 1.0 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.755 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 10' ' ' ALA . 2.8 Cg_exo -75.18 134.73 17.87 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.6 2.2 . . . . 0.0 112.334 -177.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -55.29 -44.14 51.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.14 2.56 . . . . 0.0 111.097 173.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.3 t -89.29 101.18 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.12 62.14 6.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 122.125 0.964 . . . . 0.0 111.388 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.09 -51.86 0.22 Allowed Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.293 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -87.54 159.21 7.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 121.436 1.424 . . . . 0.0 109.09 169.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.2 m -89.77 138.16 28.11 Favored Pre-proline 0 C--N 1.29 -2.003 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.12 136.26 43.63 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 N-CA-C 106.87 -2.012 . . . . 0.0 106.87 171.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 55.2 79.61 0.15 Allowed 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.572 0.701 . . . . 0.0 110.146 -173.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.0 m -66.04 139.21 21.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.508 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.422 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 13.2 t -130.22 158.17 40.48 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.485 ' C ' HD12 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.543 HG12 HD12 ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.777 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.694 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.582 HD11 HD21 ' A' ' 67' ' ' LEU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.548 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HA ' HD12 ' A' ' 67' ' ' LEU . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.579 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt -85.11 -29.15 25.07 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -76.18 70.72 2.08 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.48 -0.782 . . . . 0.0 114.018 -176.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.34 -64.62 2.45 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 114.487 0.555 . . . . 0.0 114.487 175.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -67.2 113.81 5.86 Favored Glycine 0 N--CA 1.433 -1.502 0 O-C-N 123.781 0.342 . . . . 0.0 113.88 -173.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 m -83.29 1.65 39.93 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 109.324 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.427 -1.595 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.418 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.578 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.12 154.21 24.45 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.3 mtt 73.65 152.65 0.13 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.041 1.337 . . . . 0.0 112.147 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.05 110.96 62.64 Favored Pre-proline 0 C--N 1.304 -1.387 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 26.4 Cg_exo -62.82 116.92 3.85 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.237 2.624 . . . . 0.0 112.519 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 6.0 Cg_exo -75.18 112.0 3.45 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.213 1.942 . . . . 0.0 110.037 177.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t 72.58 156.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 O-C-N 123.737 0.648 . . . . 0.0 110.264 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.5 -171.65 0.1 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 125.141 1.377 . . . . 0.0 109.732 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.34 132.3 81.27 Favored Pre-proline 0 C--N 1.318 -0.771 0 O-C-N 123.241 0.338 . . . . 0.0 110.573 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.36 19.95 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.237 2.624 . . . . 0.0 113.31 -177.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.8 m -100.46 108.14 51.63 Favored Pre-proline 0 C--N 1.284 -2.268 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -67.33 137.09 42.32 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 121.382 1.388 . . . . 0.0 111.384 -176.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -157.06 -174.16 4.79 Favored 'General case' 0 N--CA 1.398 -3.044 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.468 HG23 ' CE2' ' A' ' 22' ' ' TYR . 4.5 m -131.65 174.57 12.93 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 C-N-CA 123.825 0.85 . . . . 0.0 110.038 -178.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p -119.19 159.89 23.18 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 123.641 0.588 . . . . 0.0 109.514 174.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.552 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.499 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA2' ' HE3' ' A' ' 31' ' ' LYS . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.547 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.606 ' HB2' HD12 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.552 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt -71.43 -32.23 68.14 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -159.81 156.86 28.08 Favored Glycine 0 N--CA 1.414 -2.807 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.72 49.57 6.48 Favored Glycine 0 C--N 1.304 -1.21 0 C-N-CA 120.396 -0.907 . . . . 0.0 110.848 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.96 95.04 0.26 Allowed Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.0 m -52.39 125.72 17.01 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.165 1.386 . . . . 0.0 113.155 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.3 -1.56 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.339 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.732 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -131.06 23.23 4.9 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.7 tpp 74.93 -53.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.378 1.471 . . . . 0.0 110.224 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -126.21 144.2 48.29 Favored Pre-proline 0 C--N 1.303 -1.455 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.73 143.41 95.33 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.699 2.266 . . . . 0.0 113.085 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.54 150.38 69.34 Favored 'Trans proline' 0 C--O 1.247 0.926 0 C-N-CA 123.153 2.569 . . . . 0.0 111.952 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.9 t -83.89 72.5 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.519 0.675 . . . . 0.0 110.325 -177.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 174.49 32.92 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 125.989 1.715 . . . . 0.0 107.161 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.35 161.51 41.22 Favored Pre-proline 0 C--N 1.3 -1.554 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.397 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -77.13 -142.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.167 0 C-N-CA 122.916 2.411 . . . . 0.0 109.773 173.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -67.97 157.84 85.59 Favored Pre-proline 0 C--N 1.301 -1.523 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.72 138.74 86.45 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.495 2.13 . . . . 0.0 112.028 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -126.26 90.9 3.26 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.466 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.646 HG11 ' HZ1' ' A' ' 69' ' ' LYS . 9.3 t -104.53 154.73 6.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.596 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t -129.34 166.28 19.82 Favored 'General case' 0 N--CA 1.414 -2.243 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.601 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.506 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.494 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.554 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.554 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.548 HG12 HD12 ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.852 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.596 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.758 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.567 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.852 ' HB2' HD12 ' A' ' 43' ' ' ILE . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.695 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.695 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.646 ' HZ1' HG11 ' A' ' 20' ' ' VAL . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt -73.67 -32.56 64.04 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -122.3 119.82 4.11 Favored Glycine 0 N--CA 1.418 -2.524 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.05 38.22 27.0 Favored Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.87 90.38 0.87 Allowed Glycine 0 N--CA 1.426 -1.969 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.254 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.2 m -80.02 -39.38 30.02 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.426 -1.648 0 N-CA-C 104.997 -2.223 . . . . 0.0 104.997 177.508 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.876 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.43 77.23 9.5 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 45.8 tpp 166.92 103.7 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 127.172 2.189 . . . . 0.0 106.489 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -150.73 140.42 13.82 Favored Pre-proline 0 C--N 1.296 -1.755 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -53.43 121.98 10.44 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.614 2.209 . . . . 0.0 110.301 174.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.71 44.81 0.65 Allowed 'Trans proline' 0 N--CA 1.488 1.155 0 C-N-CA 123.728 2.952 . . . . 0.0 113.656 -177.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 p -155.31 139.12 8.31 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.22 70.28 10.09 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 122.007 0.908 . . . . 0.0 110.539 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.54 ' HB3' ' HD3' ' A' ' 16' ' ' PRO . . . -130.85 -54.6 0.03 OUTLIER Pre-proline 0 C--N 1.297 -1.681 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.479 178.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.54 ' HD3' ' HB3' ' A' ' 15' ' ' ALA . 62.3 Cg_endo -93.93 168.59 2.01 Favored 'Trans proline' 0 N--CA 1.441 -1.576 0 C-N-CA 121.549 1.5 . . . . 0.0 109.883 173.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 t -97.35 114.15 64.37 Favored Pre-proline 0 C--N 1.291 -1.954 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -68.33 136.54 37.35 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 121.05 1.167 . . . . 0.0 110.161 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 173.88 140.68 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 C-N-CA 124.088 0.955 . . . . 0.0 108.552 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.59 131.44 71.35 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 172.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t -125.2 153.11 43.61 Favored 'General case' 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.581 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.487 HG13 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.521 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.52 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 40' ' ' GLY . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' N ' HD23 ' A' ' 39' ' ' LEU . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.572 HG12 HD12 ' A' ' 52' ' ' ILE . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.848 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.756 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 67' ' ' LEU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.848 ' HB2' HD12 ' A' ' 43' ' ' ILE . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.708 ' HA ' HD12 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.445 HD22 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt -83.23 -33.41 26.1 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -119.14 48.6 0.93 Allowed Glycine 0 N--CA 1.438 -1.195 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.078 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.24 -69.44 3.27 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -127.53 -167.82 12.37 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.2 m -119.81 139.22 52.68 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.341 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.887 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 45.9 85.13 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.456 1.102 . . . . 0.0 112.393 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ptm -76.55 140.51 41.13 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -122.12 104.03 38.66 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.93 111.91 3.18 Favored 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.208 1.939 . . . . 0.0 112.519 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -64.86 -48.0 4.39 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.409 2.073 . . . . 0.0 110.798 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.8 m -126.97 111.6 26.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.041 176.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.75 177.76 3.27 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.6 -52.66 63.47 Favored Pre-proline 0 C--N 1.313 -1.009 0 O-C-N 123.335 0.397 . . . . 0.0 111.787 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -89.29 159.43 5.6 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.173 1.249 . . . . 0.0 111.218 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -115.18 160.81 32.6 Favored Pre-proline 0 C--N 1.291 -1.938 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.26 138.6 67.36 Favored 'Trans proline' 0 C--O 1.242 0.697 0 C-N-CA 121.446 1.431 . . . . 0.0 110.286 175.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 58.35 83.86 0.11 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.136 0.974 . . . . 0.0 111.779 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.564 HG23 ' CE1' ' A' ' 22' ' ' TYR . 10.5 m -85.41 166.17 2.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.949 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p -104.25 155.55 18.65 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.537 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.564 ' CE1' HG23 ' A' ' 20' ' ' VAL . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' ILE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.521 HG12 HD12 ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.746 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.586 ' HG ' HD11 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.565 HD11 HD21 ' A' ' 67' ' ' LEU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.746 ' HB2' HD12 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.706 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.706 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt -80.9 -33.41 34.25 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -144.47 149.76 21.84 Favored Glycine 0 N--CA 1.424 -2.164 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.86 -100.14 2.65 Favored Glycine 0 N--CA 1.425 -2.061 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 117.06 -55.74 0.55 Allowed Glycine 0 CA--C 1.49 -1.495 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.0 m -76.14 -21.39 56.64 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 174.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 N--CA 1.42 -1.934 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 175.827 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.45 90.23 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.529 1.132 . . . . 0.0 111.576 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 13.7 tpt 65.94 25.21 11.11 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 122.663 1.22 . . . . 0.0 109.593 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -132.93 122.67 17.67 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.214 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -58.74 120.54 8.48 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.303 2.668 . . . . 0.0 113.943 -175.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -64.4 -46.23 7.88 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.683 2.255 . . . . 0.0 110.409 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.9 t -101.37 152.5 5.19 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.4 119.62 3.13 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 124.076 0.95 . . . . 0.0 111.998 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -146.29 174.52 3.35 Favored Pre-proline 0 C--N 1.305 -1.332 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 -176.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.464 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 11.2 Cg_endo -55.92 -179.42 0.08 OUTLIER 'Trans proline' 0 CA--C 1.551 1.369 0 C-N-CA 123.097 2.531 . . . . 0.0 112.736 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 t -77.02 125.82 86.32 Favored Pre-proline 0 C--N 1.302 -1.475 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -178.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.06 137.92 50.21 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.051 1.834 . . . . 0.0 110.529 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -109.73 88.61 2.79 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-O 121.501 0.667 . . . . 0.0 111.83 -175.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -89.09 157.97 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.502 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.584 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p -126.02 155.93 40.69 Favored 'General case' 0 C--N 1.278 -2.541 0 O-C-N 123.247 0.342 . . . . 0.0 111.796 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.6 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.496 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.549 HG12 HD12 ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.794 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HB2' HD12 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -72.42 -34.38 67.79 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -110.85 25.19 15.03 Favored Glycine 0 CA--C 1.489 -1.558 0 C-N-CA 120.509 -0.853 . . . . 0.0 111.889 -176.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.63 -60.81 4.55 Favored Glycine 0 C--N 1.313 -0.706 0 C-N-CA 121.377 -0.44 . . . . 0.0 112.034 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -129.64 130.42 6.32 Favored Glycine 0 N--CA 1.427 -1.917 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 p -164.43 44.81 0.1 Allowed 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.435 -1.214 0 CA-C-N 113.476 -1.693 . . . . 0.0 107.751 -169.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.81 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 65.77 151.28 0.05 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 112.384 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . 0.424 ' HG2' ' HB ' ' A' ' 21' ' ' THR . 25.8 ptt? -136.24 168.36 19.56 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.3 150.95 74.05 Favored Pre-proline 0 C--N 1.288 -2.068 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 177.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.6 125.92 17.87 Favored 'Trans proline' 0 C--O 1.244 0.794 0 C-N-CA 122.001 1.801 . . . . 0.0 110.062 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.24 -54.54 5.29 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.197 2.598 . . . . 0.0 111.173 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.455 ' O ' ' HD2' ' A' ' 16' ' ' PRO . 59.3 t -103.16 130.65 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 172.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.21 84.78 4.41 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.684 0.754 . . . . 0.0 111.337 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.528 ' H ' ' HD2' ' A' ' 16' ' ' PRO . . . -150.0 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.923 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.528 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 32.5 Cg_endo -64.37 166.37 17.4 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.185 1.923 . . . . 0.0 110.809 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 19.6 m -87.42 133.95 37.25 Favored Pre-proline 0 C--N 1.292 -1.918 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 -177.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 17' ' ' SER . 33.4 Cg_exo -63.64 148.81 92.06 Favored 'Trans proline' 0 C--O 1.256 1.39 0 C-N-CA 122.819 2.346 . . . . 0.0 110.367 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -150.63 -168.67 3.17 Favored 'General case' 0 N--CA 1.41 -2.46 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.7 m -76.01 157.87 5.62 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.181 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.125 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.424 ' HB ' ' HG2' ' A' ' 9' ' ' MET . 12.4 t -138.24 155.12 48.95 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -177.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.436 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG3' HG13 ' A' ' 28' ' ' VAL . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.408 HG11 ' CD1' ' A' ' 22' ' ' TYR . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.557 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.508 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.557 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.504 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.669 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.499 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.669 ' HB2' HD12 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.664 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt -81.45 -32.78 32.44 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -104.46 -112.95 3.76 Favored Glycine 0 N--CA 1.434 -1.498 0 CA-C-N 115.341 -0.845 . . . . 0.0 112.414 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -72.63 95.23 0.69 Allowed Glycine 0 C--O 1.243 0.672 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.18 34.27 0.1 Allowed Glycine 0 C--N 1.291 -1.923 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.1 t -87.86 109.27 19.64 Favored 'General case' 0 N--CA 1.418 -2.048 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--N 1.287 -2.123 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.276 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.56 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t . . . . . 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.451 ' O ' HD12 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.483 ' C ' HD12 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.559 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.548 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.403 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.548 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.541 HG12 HD12 ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.715 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HG ' HD11 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.715 ' HB2' HD12 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.575 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.746 ' HA ' HD12 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.524 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt . . . . . 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.403 -2.811 0 CA-C-O 121.028 0.442 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.448 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.485 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.525 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.762 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.45 HG23 ' CH2' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.432 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' HD11 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.525 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 43' ' ' ILE . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.45 ' CH2' HG23 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.672 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt . . . . . 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.425 -1.676 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.441 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.523 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.655 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.655 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.85 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.85 ' HB2' HD12 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.468 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.584 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.662 ' HA ' HD12 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.415 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.7 mt . . . . . 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.422 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 13.2 t . . . . . 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.485 ' C ' HD12 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.543 HG12 HD12 ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.777 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.694 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.582 HD11 HD21 ' A' ' 67' ' ' LEU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.548 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HA ' HD12 ' A' ' 67' ' ' LEU . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.579 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt . . . . . 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.427 -1.579 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.552 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.499 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA2' ' HE3' ' A' ' 31' ' ' LYS . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.547 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.606 ' HB2' HD12 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.552 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt . . . . . 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.596 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t . . . . . 0 N--CA 1.414 -2.243 0 CA-C-O 120.788 0.328 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.506 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.494 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.554 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.554 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.548 HG12 HD12 ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.852 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.596 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.758 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.567 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.852 ' HB2' HD12 ' A' ' 43' ' ' ILE . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.695 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.695 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt . . . . . 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t . . . . . 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.581 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.487 HG13 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.521 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.52 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 40' ' ' GLY . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.412 ' N ' HD23 ' A' ' 39' ' ' LEU . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.572 HG12 HD12 ' A' ' 52' ' ' ILE . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.848 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' NE2' ' HB3' ' A' ' 61' ' ' TRP . 24.1 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.756 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 67' ' ' LEU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.848 ' HB2' HD12 ' A' ' 43' ' ' ILE . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.419 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.708 ' HA ' HD12 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.445 HD22 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt . . . . . 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.424 -1.751 0 CA-C-O 121.217 0.532 . . . . 0.0 111.537 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' ILE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.521 HG12 HD12 ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.746 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.586 ' HG ' HD11 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.565 HD11 HD21 ' A' ' 67' ' ' LEU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.746 ' HB2' HD12 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.706 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.706 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt . . . . . 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.412 -2.373 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.474 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.6 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.496 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.549 HG12 HD12 ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.794 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HB2' HD12 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.4 t . . . . . 0 N--CA 1.427 -1.58 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.436 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG3' HG13 ' A' ' 28' ' ' VAL . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.408 HG11 ' CD1' ' A' ' 22' ' ' TYR . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.557 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.508 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.557 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.504 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.669 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.499 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.669 ' HB2' HD12 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.664 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt . . . . . 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.567 0 N-CA-C 110.937 -0.865 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -115.02 120.81 41.1 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 50.6 ttm 74.4 -44.26 0.55 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 125.147 1.379 . . . . 0.0 112.543 178.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -119.36 86.71 34.09 Favored Pre-proline 0 C--N 1.303 -1.433 0 O-C-N 122.303 -0.248 . . . . 0.0 110.336 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HD2' ' HD2' ' A' ' 18' ' ' PRO . 6.5 Cg_exo -78.53 150.5 24.89 Favored 'Trans proline' 0 N--CA 1.448 -1.185 0 C-N-CA 122.093 1.862 . . . . 0.0 110.096 175.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 14.1 Cg_exo -68.58 102.43 0.85 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.512 2.141 . . . . 0.0 112.698 -177.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.2 m -141.5 -175.79 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 C-N-CA 123.279 0.632 . . . . 0.0 110.47 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -101.22 30.4 4.18 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.923 0.868 . . . . 0.0 109.744 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.29 166.35 20.57 Favored Pre-proline 0 C--N 1.301 -1.516 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.43 ' O ' ' HD3' ' A' ' 18' ' ' PRO . 37.4 Cg_exo -64.2 -168.97 0.1 Allowed 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.978 2.452 . . . . 0.0 112.734 178.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.6 m -71.45 108.55 4.04 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.663 0.385 . . . . 0.0 110.987 -179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.563 ' HD2' ' HD2' ' A' ' 11' ' ' PRO . 36.9 Cg_exo -66.6 138.41 49.6 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 123.845 3.03 . . . . 0.0 113.369 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.63 83.69 1.98 Allowed 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.4 m -125.53 151.16 31.27 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.022 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.56 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 15.1 t -127.72 156.18 42.82 Favored 'General case' 0 N--CA 1.423 -1.818 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -140.1 156.72 46.44 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.28 147.23 26.93 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 41.2 mt -65.35 160.75 21.13 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 68.44 19.42 8.82 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.791 0.836 . . . . 0.0 111.126 176.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -113.56 137.28 51.8 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -85.48 136.15 33.55 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 177.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.451 ' O ' HD12 ' A' ' 39' ' ' LEU . 4.1 m -144.23 153.08 15.39 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.829 0 C-N-CA 124.058 0.943 . . . . 0.0 109.27 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.483 ' C ' HD12 ' A' ' 30' ' ' ILE . 51.3 m-85 -86.55 138.87 31.36 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 119.977 -0.689 . . . . 0.0 109.529 177.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.559 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -123.36 127.12 74.17 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.054 0 C-N-CA 123.711 0.804 . . . . 0.0 110.499 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.548 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 80.6 tttt -86.11 130.92 34.38 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.588 175.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.4 t -93.25 164.49 13.21 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 105.451 -2.055 . . . . 0.0 105.451 171.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -60.05 -22.91 63.28 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.32 0.581 . . . . 0.0 111.536 -176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.403 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 37.5 t70 -72.95 -11.87 60.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.59 0.71 . . . . 0.0 111.631 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.47 -11.96 54.32 Favored Glycine 0 CA--C 1.504 -0.635 0 C-N-CA 120.763 -0.732 . . . . 0.0 113.316 175.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.403 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 4.2 mpt_? -80.65 143.18 33.28 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 120.583 0.23 . . . . 0.0 111.524 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.548 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 11.0 m-85 -104.72 130.7 52.73 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.136 176.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -117.67 129.4 55.71 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 114.72 -1.127 . . . . 0.0 108.702 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 28' ' ' VAL . 36.7 tp -82.1 132.08 35.24 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 177.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -148.78 166.57 29.28 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.073 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.9 m -104.69 127.0 52.31 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 123.852 0.861 . . . . 0.0 109.237 -177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.541 HG12 HD12 ' A' ' 52' ' ' ILE . 33.6 mt -70.2 131.19 34.48 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 122.248 -0.283 . . . . 0.0 110.706 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.715 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.08 -29.42 2.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 178.453 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -151.68 156.55 40.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -135.95 149.99 49.12 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 120.852 0.358 . . . . 0.0 111.269 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 70.9 p -124.59 179.46 4.95 Favored 'General case' 0 C--N 1.29 -2.02 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 168.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.7 m -77.46 -15.4 59.34 Favored 'General case' 0 C--N 1.294 -1.817 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.493 177.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -108.17 -28.99 9.17 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -142.96 164.48 29.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 121.552 0.691 . . . . 0.0 111.107 -174.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 85.7 m-85 -127.33 131.05 50.5 Favored 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 115.303 -0.862 . . . . 0.0 108.794 177.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.709 ' HG ' HD11 ' A' ' 43' ' ' ILE . 30.9 tp -85.37 114.88 22.76 Favored 'General case' 0 CA--C 1.483 -1.63 0 N-CA-C 106.749 -1.575 . . . . 0.0 106.749 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.575 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 19.5 mm -111.15 130.92 63.73 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.412 -176.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.715 ' HB2' HD12 ' A' ' 43' ' ' ILE . 17.8 ttt180 -102.84 114.78 29.32 Favored 'General case' 0 N--CA 1.419 -1.98 0 N-CA-C 106.216 -1.772 . . . . 0.0 106.216 173.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -78.31 177.43 8.45 Favored 'General case' 0 C--N 1.273 -2.757 0 CA-C-N 115.563 -0.744 . . . . 0.0 112.167 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -61.34 -30.83 70.75 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.573 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -84.7 9.02 15.04 Favored 'General case' 0 CA--C 1.551 1.014 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.715 178.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 67.51 7.56 5.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.452 1.501 . . . . 0.0 113.654 174.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.484 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 49.5 m -76.02 144.18 41.02 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.575 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 41.2 mt-10 -114.8 126.6 55.02 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -140.7 144.67 35.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -89.13 110.16 20.92 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 40.6 m -111.12 139.24 46.65 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.224 -176.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -71.83 154.34 92.83 Favored Pre-proline 0 C--N 1.301 -1.535 0 O-C-N 123.496 0.497 . . . . 0.0 110.506 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.746 ' HA ' HD12 ' A' ' 67' ' ' LEU . 36.4 Cg_endo -61.09 -18.19 56.61 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.12 2.547 . . . . 0.0 114.577 -172.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -73.81 -23.43 59.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.135 0.493 . . . . 0.0 110.603 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 46.6 mmtm -84.69 -15.21 46.04 Favored 'General case' 0 CA--C 1.494 -1.177 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.481 -176.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.746 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.5 mt -98.34 133.53 42.61 Favored 'General case' 0 CA--C 1.479 -1.772 0 O-C-N 123.928 0.767 . . . . 0.0 110.163 -173.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.524 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 15.1 mmm180 -126.99 140.64 52.16 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 177.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.84 147.4 39.14 Favored 'General case' 0 C--N 1.313 -1.006 0 O-C-N 123.571 0.544 . . . . 0.0 109.724 -177.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 44.5 mt -82.61 -32.25 28.45 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.601 -0.44 . . . . 0.0 112.172 -179.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -129.73 54.59 0.78 Allowed Glycine 0 CA--C 1.499 -0.964 0 C-N-CA 119.755 -1.212 . . . . 0.0 112.226 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.42 -67.26 3.12 Favored Glycine 0 C--N 1.319 -0.397 0 C-N-CA 121.577 -0.344 . . . . 0.0 112.549 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 89.22 133.77 4.96 Favored Glycine 0 N--CA 1.434 -1.433 0 C-N-CA 121.745 -0.264 . . . . 0.0 112.49 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.1 m -97.11 -0.38 47.14 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-O 122.476 1.132 . . . . 0.0 109.205 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.418 -2.06 0 N-CA-C 104.389 -2.449 . . . . 0.0 104.389 179.167 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.501 ' O ' ' HG2' ' A' ' 63' ' ' GLU . . . . . . . . 0 CA--C 1.494 -1.252 0 N-CA-C 110.016 -1.234 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -178.81 138.28 0.16 Allowed 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 123.939 0.896 . . . . 0.0 109.638 176.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 55.9 mtt -86.29 75.5 9.83 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -167.9 161.31 9.69 Favored Pre-proline 0 C--N 1.304 -1.393 0 CA-C-N 114.086 -1.416 . . . . 0.0 107.363 -177.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.615 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 31.2 Cg_exo -67.01 178.64 2.77 Favored 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 122.458 2.105 . . . . 0.0 110.152 170.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -45.99 128.03 11.07 Favored 'Trans proline' 0 C--N 1.371 1.716 0 C-N-CA 122.889 2.392 . . . . 0.0 112.75 177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 31.6 m -79.06 153.52 4.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.959 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.869 -178.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 63.24 27.17 15.45 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.075 0.95 . . . . 0.0 111.241 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 17' ' ' SER . . . -122.51 169.88 8.94 Favored Pre-proline 0 C--N 1.296 -1.722 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.409 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 60.5 Cg_endo -73.19 19.35 0.37 Allowed 'Trans proline' 0 CA--C 1.551 1.344 0 C-N-CA 122.021 1.814 . . . . 0.0 113.178 178.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.416 ' H ' ' C ' ' A' ' 15' ' ' ALA . 20.4 m -100.17 147.18 33.16 Favored Pre-proline 0 C--N 1.292 -1.933 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.615 ' O ' ' HD2' ' A' ' 11' ' ' PRO . 34.4 Cg_exo -61.49 137.44 69.64 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.156 1.904 . . . . 0.0 113.85 -175.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -174.39 134.02 0.4 Allowed 'General case' 0 N--CA 1.435 -1.209 0 N-CA-C 107.001 -1.481 . . . . 0.0 107.001 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.9 m -81.13 154.11 4.23 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.767 0 CA-C-O 121.358 0.599 . . . . 0.0 111.102 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.0 p -130.81 150.52 51.94 Favored 'General case' 0 N--CA 1.403 -2.811 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.063 -179.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.448 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -129.23 158.83 37.95 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.448 -175.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.82 152.41 34.48 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 39.0 mt -65.05 158.82 24.67 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 120.736 0.303 . . . . 0.0 110.801 178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 68.07 9.49 7.21 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 124.922 1.289 . . . . 0.0 111.586 178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -93.78 141.71 28.19 Favored 'General case' 0 N--CA 1.428 -1.574 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 16.2 m-20 -97.0 127.9 43.43 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.0 m -143.98 153.17 15.7 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.808 0 C-N-CA 123.06 0.544 . . . . 0.0 111.122 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.485 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 45.7 m-85 -85.9 139.91 30.83 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 175.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -121.65 117.88 54.0 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.336 0 O-C-N 123.854 0.721 . . . . 0.0 109.947 -178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 77.9 tttt -79.38 124.79 28.76 Favored 'General case' 0 C--N 1.278 -2.504 0 CA-C-N 114.083 -1.417 . . . . 0.0 109.561 175.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.405 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 42.0 t -80.05 168.98 18.48 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 173.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -61.57 -26.94 68.28 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.556 0.693 . . . . 0.0 109.395 -176.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' OD1' ' HD3' ' A' ' 36' ' ' ARG . 19.2 t70 -76.6 -13.85 60.04 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.943 179.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 107.76 -10.25 37.97 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 120.339 -0.934 . . . . 0.0 115.355 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.446 ' HD3' ' OD1' ' A' ' 34' ' ' ASP . 6.6 mpt_? -83.91 145.68 28.45 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 117.605 0.703 . . . . 0.0 111.746 -179.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 28.5 m-85 -105.14 133.83 49.26 Favored 'General case' 0 CA--C 1.505 -0.78 0 O-C-N 123.697 0.623 . . . . 0.0 112.373 -177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -122.05 131.6 54.07 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.046 -0.979 . . . . 0.0 108.961 176.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.6 tp -85.97 121.37 28.5 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-O 120.994 0.426 . . . . 0.0 111.465 -178.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -140.75 172.92 23.41 Favored Glycine 0 N--CA 1.437 -1.259 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 12.9 m -110.44 133.9 52.84 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.525 HG12 ' CD1' ' A' ' 52' ' ' ILE . 23.9 mt -74.16 130.8 35.75 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 O-C-N 122.343 -0.223 . . . . 0.0 110.474 -179.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.762 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -111.51 -32.09 2.22 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 N-CA-C 112.748 0.648 . . . . 0.0 112.748 179.4 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -147.23 157.4 43.58 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 -178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -137.54 146.51 44.2 Favored 'General case' 0 C--N 1.287 -2.12 0 O-C-N 123.288 0.368 . . . . 0.0 110.272 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.45 HG23 ' CH2' ' A' ' 61' ' ' TRP . 44.7 p -114.69 -168.61 1.4 Allowed 'General case' 0 C--N 1.281 -2.377 0 N-CA-C 105.368 -2.086 . . . . 0.0 105.368 170.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 t -76.75 -27.07 55.22 Favored 'General case' 0 C--N 1.296 -1.744 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.155 179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.432 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 8.4 m-20 -103.98 -43.93 5.15 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.367 -177.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -121.08 167.99 12.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 -168.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -129.26 131.89 47.1 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 114.595 -1.184 . . . . 0.0 109.593 -178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.697 ' HG ' HD11 ' A' ' 43' ' ' ILE . 33.6 tp -85.73 118.01 24.97 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 106.255 -1.758 . . . . 0.0 106.255 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.525 ' CD1' HG12 ' A' ' 42' ' ' ILE . 17.6 mm -110.98 131.61 61.71 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.935 0 O-C-N 123.509 0.506 . . . . 0.0 110.217 -177.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.762 ' HB2' HD12 ' A' ' 43' ' ' ILE . 32.2 ttm180 -104.96 118.34 36.28 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -88.66 176.0 7.29 Favored 'General case' 0 C--N 1.286 -2.153 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.638 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -64.65 -25.18 67.84 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.126 0.489 . . . . 0.0 112.197 -175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.76 14.43 8.63 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.374 0.607 . . . . 0.0 110.106 -179.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 71.73 8.35 6.1 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.171 1.788 . . . . 0.0 113.697 174.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 19.5 m -75.71 138.14 41.1 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 178.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.475 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.0 mt-10 -114.93 125.59 53.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -134.61 143.65 47.44 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -177.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.45 ' CH2' HG23 ' A' ' 46' ' ' THR . 95.1 m95 -88.61 109.82 20.41 Favored 'General case' 0 CA--C 1.493 -1.246 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.9 m -110.9 145.45 38.28 Favored 'General case' 0 N--CA 1.415 -2.211 0 CA-C-N 114.647 -1.161 . . . . 0.0 109.794 -174.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 16.9 mt-10 -74.04 150.96 88.23 Favored Pre-proline 0 C--N 1.299 -1.588 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.64 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.672 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.0 Cg_endo -63.77 -23.22 69.31 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.812 2.342 . . . . 0.0 112.169 -178.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -73.99 -12.19 60.56 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.216 175.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 46.5 mmtm -96.33 -17.36 20.74 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.023 0.44 . . . . 0.0 110.672 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -94.32 142.53 27.31 Favored 'General case' 0 C--N 1.291 -1.944 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.47 -175.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.3 mmm180 -135.14 134.06 39.82 Favored 'General case' 0 C--N 1.307 -1.239 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 72' ' ' GLY . 0.2 OUTLIER -74.25 142.73 45.29 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.423 -0.511 . . . . 0.0 110.276 178.337 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 21.6 mt -79.49 -33.59 42.07 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.195 0.522 . . . . 0.0 109.675 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -168.7 53.43 0.21 Allowed Glycine 0 CA--C 1.494 -1.276 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.539 ' O ' ' HG2' ' A' ' 69' ' ' LYS . . . -163.25 53.77 0.29 Allowed Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.709 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -46.51 -50.77 13.35 Favored Glycine 0 C--N 1.344 1.013 0 O-C-N 124.289 0.64 . . . . 0.0 112.424 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 25.6 m -128.91 -64.33 0.92 Allowed 'General case' 0 C--N 1.297 -1.692 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 175.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 60.0 m . . . . . 0 CA--C 1.499 -0.983 0 N-CA-C 103.424 -2.806 . . . . 0.0 103.424 176.033 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.15 97.18 0.04 OUTLIER 'General case' 0 C--O 1.248 1.01 0 C-N-CA 124.801 1.24 . . . . 0.0 111.911 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 26.4 mmt -78.71 107.93 11.76 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 121.523 0.678 . . . . 0.0 109.95 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -118.37 146.69 40.13 Favored Pre-proline 0 C--N 1.296 -1.758 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -68.11 140.42 49.49 Favored 'Trans proline' 0 N--CA 1.45 -1.043 0 C-N-CA 121.874 1.716 . . . . 0.0 111.176 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.85 50.67 1.46 Allowed 'Trans proline' 0 CA--C 1.554 1.517 0 C-N-CA 123.368 2.712 . . . . 0.0 112.401 178.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.7 t 69.47 -68.28 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 125.554 1.541 . . . . 0.0 111.548 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -92.12 88.3 6.46 Favored 'General case' 0 C--O 1.251 1.168 0 CA-C-O 121.201 0.525 . . . . 0.0 109.794 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.5 167.18 11.67 Favored Pre-proline 0 C--N 1.309 -1.19 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.591 -177.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -73.63 -157.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 122.299 1.999 . . . . 0.0 110.886 174.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.0 m -69.07 147.73 97.66 Favored Pre-proline 0 C--N 1.308 -1.227 0 O-C-N 122.172 -0.33 . . . . 0.0 110.418 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -62.35 137.78 67.42 Favored 'Trans proline' 0 C--O 1.25 1.077 0 C-N-CA 121.766 1.644 . . . . 0.0 111.163 177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 57.67 79.35 0.2 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 124.969 1.308 . . . . 0.0 112.245 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.5 m -77.17 145.1 10.68 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.646 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.173 176.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.8 t -122.43 162.25 22.0 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -178.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.441 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 88.9 m-85 -136.96 159.52 41.64 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 122.639 0.375 . . . . 0.0 111.401 -174.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.0 160.68 23.04 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.911 0.485 . . . . 0.0 109.9 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.78 157.06 31.3 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.972 0.415 . . . . 0.0 111.306 178.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 68.35 5.47 4.76 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.268 1.427 . . . . 0.0 112.379 178.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -86.61 128.55 35.0 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -87.73 127.31 35.31 Favored 'General case' 0 CA--C 1.485 -1.543 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.5 m -143.64 154.43 16.15 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 -174.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.523 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 48.2 m-85 -85.89 139.67 31.05 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.15 119.84 59.62 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.406 0 C-N-CA 123.754 0.822 . . . . 0.0 109.507 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 76.7 tttt -81.75 124.32 29.52 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.013 175.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.43 171.79 9.85 Favored 'General case' 0 C--N 1.283 -2.316 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 176.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -63.66 -25.0 68.01 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 122.886 0.474 . . . . 0.0 111.864 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.655 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 10.1 p-10 -85.45 2.56 44.06 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.855 0.36 . . . . 0.0 111.211 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 92.68 -3.84 75.12 Favored Glycine 0 C--O 1.241 0.536 0 N-CA-C 115.154 0.822 . . . . 0.0 115.154 173.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.655 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 5.6 mpt_? -85.64 152.3 23.22 Favored 'General case' 0 CA--C 1.497 -1.063 0 CA-C-N 117.414 0.607 . . . . 0.0 111.364 178.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.523 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 18.3 m-85 -105.44 133.62 49.9 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.405 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -119.59 130.6 55.2 Favored 'General case' 0 C--N 1.29 -2.009 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 177.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 25.2 tp -88.48 118.43 28.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-O 120.835 0.35 . . . . 0.0 110.752 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.93 174.36 21.92 Favored Glycine 0 N--CA 1.442 -0.946 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.306 -178.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.7 m -111.61 132.18 54.74 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 123.394 0.678 . . . . 0.0 109.575 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 36.0 mt -73.86 127.94 35.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 O-C-N 122.149 -0.344 . . . . 0.0 110.591 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.85 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -109.54 -29.94 2.46 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.823 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -149.23 156.45 42.15 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 106.754 -1.572 . . . . 0.0 106.754 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -144.14 142.85 30.82 Favored 'General case' 0 C--N 1.294 -1.843 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.649 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.6 p -120.92 -175.99 3.16 Favored 'General case' 0 N--CA 1.426 -1.631 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 173.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.0 m -76.97 -20.51 56.01 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 118.338 0.517 . . . . 0.0 110.591 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -109.73 -34.37 6.49 Favored 'General case' 0 CA--C 1.499 -1.017 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.514 -177.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -132.04 161.33 33.45 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 121.37 0.605 . . . . 0.0 111.453 -173.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -126.98 130.6 50.37 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.715 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.6 tp -85.6 116.13 23.71 Favored 'General case' 0 CA--C 1.492 -1.25 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.6 mm -111.0 129.41 66.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.708 0 O-C-N 123.261 0.351 . . . . 0.0 110.66 -177.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.85 ' HB2' HD12 ' A' ' 43' ' ' ILE . 20.2 ttt180 -106.11 115.79 30.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -83.22 178.08 8.25 Favored 'General case' 0 C--N 1.279 -2.486 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.117 -177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.3 -26.17 68.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 121.808 0.813 . . . . 0.0 110.71 -176.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -85.46 8.51 18.81 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.749 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 70.2 8.78 6.79 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.359 1.463 . . . . 0.0 113.802 173.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.468 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 17.0 m -77.83 137.69 38.55 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 176.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.584 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.5 mt-10 -114.98 126.28 54.58 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 -177.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 41.9 tp60 -134.89 142.43 46.57 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -89.15 109.43 20.29 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 32.6 m -110.47 154.32 23.8 Favored 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.803 -172.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -75.21 146.75 82.21 Favored Pre-proline 0 CA--C 1.507 -0.71 0 O-C-N 123.598 0.561 . . . . 0.0 110.045 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.662 ' HA ' HD12 ' A' ' 67' ' ' LEU . 14.0 Cg_exo -57.18 -28.05 77.46 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.091 2.527 . . . . 0.0 113.229 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.67 -16.23 61.7 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 120.936 0.398 . . . . 0.0 111.417 176.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.415 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 48.2 mmtm -88.78 -20.19 25.05 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.854 0.359 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.662 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -90.85 135.7 33.56 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.241 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -133.16 136.17 45.58 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -68.19 146.22 53.59 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.835 0.709 . . . . 0.0 109.899 178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 24.7 mt -80.53 -24.07 39.58 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-O 120.57 0.224 . . . . 0.0 110.677 -179.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 75' ' ' SER . . . -92.32 -79.8 1.42 Allowed Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.565 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -161.89 -8.5 0.04 OUTLIER Glycine 0 CA--C 1.529 0.935 0 C-N-CA 120.149 -1.024 . . . . 0.0 115.054 -178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 145.22 -70.89 0.37 Allowed Glycine 0 CA--C 1.497 -1.082 0 C-N-CA 119.032 -1.556 . . . . 0.0 112.095 179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 14.6 m -67.24 -31.45 71.8 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 175.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.443 ' O ' ' HA3' ' A' ' 71' ' ' GLY . 10.5 t . . . . . 0 N--CA 1.407 -2.625 0 N-CA-C 103.475 -2.787 . . . . 0.0 103.475 173.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.217 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -161.01 -38.68 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 116.956 0.378 . . . . 0.0 110.299 -179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ttt 70.65 28.75 3.44 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 122.296 1.046 . . . . 0.0 108.702 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . . . -87.43 108.76 21.33 Favored Pre-proline 0 C--O 1.248 1.0 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.755 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 10' ' ' ALA . 2.8 Cg_exo -75.18 134.73 17.87 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 122.6 2.2 . . . . 0.0 112.334 -177.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -55.29 -44.14 51.87 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 123.14 2.56 . . . . 0.0 111.097 173.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.3 t -89.29 101.18 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.357 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 176.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.12 62.14 6.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 122.125 0.964 . . . . 0.0 111.388 -177.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.09 -51.86 0.22 Allowed Pre-proline 0 C--N 1.289 -2.049 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.293 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -87.54 159.21 7.92 Favored 'Trans proline' 0 C--N 1.362 1.268 0 C-N-CA 121.436 1.424 . . . . 0.0 109.09 169.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.2 m -89.77 138.16 28.11 Favored Pre-proline 0 C--N 1.29 -2.003 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.12 136.26 43.63 Favored 'Trans proline' 0 N--CA 1.441 -1.6 0 N-CA-C 106.87 -2.012 . . . . 0.0 106.87 171.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 55.2 79.61 0.15 Allowed 'General case' 0 C--O 1.247 0.953 0 CA-C-O 121.572 0.701 . . . . 0.0 110.146 -173.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.0 m -66.04 139.21 21.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.508 -178.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.422 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 13.2 t -130.22 158.17 40.48 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.73 158.7 43.45 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.543 -175.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.81 155.51 20.16 Favored 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.04 158.03 29.43 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 121.186 -0.206 . . . . 0.0 110.574 175.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 66.44 17.24 10.63 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.9 1.28 . . . . 0.0 110.962 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -95.82 128.84 43.05 Favored 'General case' 0 C--N 1.296 -1.739 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 24.3 m-20 -87.41 128.74 35.2 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 176.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.3 161.52 15.03 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.776 0 C-N-CA 123.837 0.855 . . . . 0.0 110.462 -176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.485 ' C ' HD12 ' A' ' 30' ' ' ILE . 54.6 m-85 -90.97 139.41 30.79 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.388 -0.525 . . . . 0.0 109.761 174.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.485 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.49 124.32 70.51 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.332 0 C-N-CA 123.906 0.883 . . . . 0.0 109.762 -178.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.579 ' O ' ' HD2' ' A' ' 66' ' ' LYS . 79.3 tttt -84.54 127.7 34.19 Favored 'General case' 0 C--N 1.28 -2.432 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.364 175.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.84 166.94 13.23 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -61.8 -21.14 64.34 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-O 122.047 0.927 . . . . 0.0 109.726 178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -75.3 -7.01 52.79 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.503 -1.226 . . . . 0.0 111.725 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 85.16 2.16 88.12 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.303 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -93.04 151.41 19.9 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 177.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.454 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 10.8 m-85 -105.85 129.66 53.98 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 123.786 0.679 . . . . 0.0 110.415 176.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.6 m-85 -117.41 128.96 55.53 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.3 tt -84.97 129.31 34.82 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.43 172.05 27.91 Favored Glycine 0 N--CA 1.427 -1.935 0 C-N-CA 119.56 -1.305 . . . . 0.0 112.843 179.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 8.0 m -104.84 128.83 53.18 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.417 0.687 . . . . 0.0 109.533 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.543 HG12 HD12 ' A' ' 52' ' ' ILE . 25.8 mt -72.42 134.49 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 O-C-N 121.982 -0.449 . . . . 0.0 110.87 179.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.777 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -115.25 -32.36 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 177.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -147.84 158.16 43.9 Favored 'General case' 0 CA--C 1.507 -0.707 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.234 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -138.64 150.53 46.35 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 120.772 0.32 . . . . 0.0 110.945 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 31.1 p -124.59 -166.47 1.52 Allowed 'General case' 0 C--N 1.294 -1.845 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 173.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.7 m -77.0 -31.65 56.6 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 118.807 0.73 . . . . 0.0 110.076 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 19.0 m-20 -108.69 -28.22 9.37 Favored 'General case' 0 CA--C 1.499 -0.984 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -173.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -133.32 166.85 21.54 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.45 0.643 . . . . 0.0 112.129 -174.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.422 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 95.7 m-85 -127.25 137.19 52.82 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.279 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.694 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.6 tp -90.64 118.3 29.97 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.582 HD11 HD21 ' A' ' 67' ' ' LEU . 14.2 mm -111.45 133.84 55.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 O-C-N 123.481 0.488 . . . . 0.0 110.627 -177.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.777 ' HB2' HD12 ' A' ' 43' ' ' ILE . 15.2 ttt180 -107.75 118.27 36.31 Favored 'General case' 0 N--CA 1.444 -0.769 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -90.27 178.85 6.04 Favored 'General case' 0 C--N 1.29 -2.004 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.873 -176.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -59.53 -30.16 68.4 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.358 0.663 . . . . 0.0 112.466 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -85.03 8.19 18.74 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.361 178.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 71.22 8.78 6.49 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 125.8 1.64 . . . . 0.0 113.614 175.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 16.6 m -76.24 139.9 41.36 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.548 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.4 mt-10 -114.87 125.69 53.95 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -179.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -135.71 146.13 47.4 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 -177.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -89.58 117.13 28.24 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.5 m -122.22 145.47 48.18 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.067 -176.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -72.46 159.06 86.36 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-O 119.735 -0.174 . . . . 0.0 110.729 -179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HA ' HD12 ' A' ' 67' ' ' LEU . 9.8 Cg_exo -64.7 -23.24 63.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 C-N-CA 122.984 2.456 . . . . 0.0 112.192 -177.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -73.25 -26.77 61.24 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.719 0.771 . . . . 0.0 110.301 177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.579 ' HD2' ' O ' ' A' ' 31' ' ' LYS . 28.8 mmtp -79.13 -18.17 53.7 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.567 -178.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.688 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.9 mt -96.66 133.97 40.51 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.844 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -121.94 131.9 54.26 Favored 'General case' 0 C--N 1.29 -1.991 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 177.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -69.04 144.61 53.98 Favored 'General case' 0 C--N 1.322 -0.587 0 O-C-N 123.474 0.484 . . . . 0.0 109.789 -178.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 29.2 mt -85.11 -29.15 25.07 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.0 -0.68 . . . . 0.0 110.074 178.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -76.18 70.72 2.08 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.48 -0.782 . . . . 0.0 114.018 -176.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.34 -64.62 2.45 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 114.487 0.555 . . . . 0.0 114.487 175.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -67.2 113.81 5.86 Favored Glycine 0 N--CA 1.433 -1.502 0 O-C-N 123.781 0.342 . . . . 0.0 113.88 -173.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.7 m -83.29 1.65 39.93 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.824 0.821 . . . . 0.0 109.324 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 46.5 m . . . . . 0 N--CA 1.427 -1.595 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.418 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.489 -1.578 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -83.12 154.21 24.45 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 65.3 mtt 73.65 152.65 0.13 Allowed 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.041 1.337 . . . . 0.0 112.147 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.05 110.96 62.64 Favored Pre-proline 0 C--N 1.304 -1.387 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 12' ' ' PRO . 26.4 Cg_exo -62.82 116.92 3.85 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.237 2.624 . . . . 0.0 112.519 -178.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 11' ' ' PRO . 6.0 Cg_exo -75.18 112.0 3.45 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 122.213 1.942 . . . . 0.0 110.037 177.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t 72.58 156.45 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 O-C-N 123.737 0.648 . . . . 0.0 110.264 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.5 -171.65 0.1 Allowed 'General case' 0 C--O 1.242 0.688 0 C-N-CA 125.141 1.377 . . . . 0.0 109.732 -178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.34 132.3 81.27 Favored Pre-proline 0 C--N 1.318 -0.771 0 O-C-N 123.241 0.338 . . . . 0.0 110.573 179.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.36 19.95 0.43 Allowed 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.237 2.624 . . . . 0.0 113.31 -177.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.8 m -100.46 108.14 51.63 Favored Pre-proline 0 C--N 1.284 -2.268 0 N-CA-C 106.346 -1.724 . . . . 0.0 106.346 175.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -67.33 137.09 42.32 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 121.382 1.388 . . . . 0.0 111.384 -176.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -157.06 -174.16 4.79 Favored 'General case' 0 N--CA 1.398 -3.044 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.468 HG23 ' CE2' ' A' ' 22' ' ' TYR . 4.5 m -131.65 174.57 12.93 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.082 0 C-N-CA 123.825 0.85 . . . . 0.0 110.038 -178.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.6 p -119.19 159.89 23.18 Favored 'General case' 0 C--N 1.296 -1.747 0 O-C-N 123.641 0.588 . . . . 0.0 109.514 174.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.552 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 86.4 m-85 -127.58 158.9 36.24 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.693 -175.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.92 154.38 33.06 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.538 -177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.4 mt -66.03 154.21 40.12 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 120.566 0.222 . . . . 0.0 110.502 176.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 69.45 6.23 5.58 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.11 1.364 . . . . 0.0 111.362 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -87.86 131.69 34.46 Favored 'General case' 0 N--CA 1.427 -1.618 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 179.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 13.8 m-20 -91.1 128.01 36.75 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.74 161.06 16.31 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.854 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.654 -173.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.516 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 38.8 m-85 -94.47 140.76 29.41 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.499 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -121.7 120.92 63.03 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 C-N-CA 123.491 0.717 . . . . 0.0 110.101 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.3 tttt -84.92 131.04 34.54 Favored 'General case' 0 C--N 1.284 -2.277 0 CA-C-N 114.603 -1.181 . . . . 0.0 110.118 178.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.4 p -92.41 173.68 7.68 Favored 'General case' 0 C--N 1.29 -2.004 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -65.85 -15.57 63.03 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -82.47 -12.59 57.73 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.598 0.713 . . . . 0.0 110.383 175.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA2' ' HE3' ' A' ' 31' ' ' LYS . . . 100.89 7.51 50.34 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.794 -0.717 . . . . 0.0 114.096 177.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.538 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 19.3 mmt180 -94.29 145.38 24.78 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 122.353 -0.498 . . . . 0.0 110.356 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.516 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 26.0 m-85 -105.24 129.44 53.61 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-O 121.466 0.65 . . . . 0.0 111.421 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -118.34 128.05 54.28 Favored 'General case' 0 C--N 1.285 -2.212 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 178.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 tt -82.06 130.29 35.04 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -177.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -147.77 172.6 28.07 Favored Glycine 0 N--CA 1.417 -2.593 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.178 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 20.6 m -111.52 134.9 52.77 Favored 'General case' 0 C--N 1.296 -1.747 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.547 HG12 ' CD1' ' A' ' 52' ' ' ILE . 28.8 mt -76.49 128.28 37.67 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.117 0 O-C-N 122.07 -0.394 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.606 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -106.21 -35.9 3.36 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.104 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -143.94 157.38 44.38 Favored 'General case' 0 CA--C 1.501 -0.92 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 -179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -138.23 147.58 43.89 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-O 120.844 0.354 . . . . 0.0 111.279 -178.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 40.9 p -124.54 -175.03 3.16 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 174.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.5 m -75.99 -24.98 55.37 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.563 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.424 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 40.9 m-20 -108.98 -30.46 8.07 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -131.18 163.02 28.64 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 121.578 0.704 . . . . 0.0 112.554 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -125.01 131.19 53.45 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.951 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.2 tp -86.21 115.49 23.8 Favored 'General case' 0 CA--C 1.497 -1.061 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.547 ' CD1' HG12 ' A' ' 42' ' ' ILE . 15.8 mm -110.69 134.43 52.96 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 O-C-N 123.348 0.405 . . . . 0.0 111.069 -175.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.606 ' HB2' HD12 ' A' ' 43' ' ' ILE . 42.8 ttt180 -100.37 118.42 36.59 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 123.87 0.868 . . . . 0.0 108.707 176.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -93.15 178.26 5.8 Favored 'General case' 0 C--N 1.285 -2.202 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.527 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -62.82 -24.73 67.9 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -177.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -84.79 7.89 19.14 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-O 121.815 0.817 . . . . 0.0 109.279 178.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 69.42 10.15 7.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.582 1.553 . . . . 0.0 111.256 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 9.5 m -75.67 141.43 42.76 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.534 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 49.3 mt-10 -114.47 129.06 56.63 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -135.73 145.29 46.49 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -88.79 114.16 25.11 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 17.7 m -115.9 152.45 33.39 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.516 -175.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -78.48 152.15 78.13 Favored Pre-proline 0 C--N 1.302 -1.479 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 10.9 Cg_exo -61.0 -23.22 77.01 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 123.01 2.473 . . . . 0.0 110.307 177.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -62.77 -28.01 69.69 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.546 1.539 . . . . 0.0 111.322 175.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -97.4 -6.83 33.15 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.954 -176.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.8 mt -100.3 147.27 25.96 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 116.858 -0.155 . . . . 0.0 111.239 -174.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 71.5 mmt-85 -140.64 132.57 27.66 Favored 'General case' 0 C--N 1.317 -0.812 0 O-C-N 123.657 0.598 . . . . 0.0 109.992 176.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.552 ' HD2' ' CE1' ' A' ' 22' ' ' TYR . 2.3 mptp? -66.9 138.12 57.06 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 19.7 mt -71.43 -32.23 68.14 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 122.203 1.001 . . . . 0.0 108.38 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -159.81 156.86 28.08 Favored Glycine 0 N--CA 1.414 -2.807 0 N-CA-C 108.013 -2.035 . . . . 0.0 108.013 177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.72 49.57 6.48 Favored Glycine 0 C--N 1.304 -1.21 0 C-N-CA 120.396 -0.907 . . . . 0.0 110.848 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -66.96 95.04 0.26 Allowed Glycine 0 N--CA 1.445 -0.766 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.0 m -52.39 125.72 17.01 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 125.165 1.386 . . . . 0.0 113.155 -177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.8 m . . . . . 0 C--N 1.3 -1.56 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.339 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.732 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -131.06 23.23 4.9 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 49.7 tpp 74.93 -53.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.378 1.471 . . . . 0.0 110.224 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -126.21 144.2 48.29 Favored Pre-proline 0 C--N 1.303 -1.455 0 N-CA-C 106.573 -1.639 . . . . 0.0 106.573 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.73 143.41 95.33 Favored 'Trans proline' 0 C--O 1.243 0.73 0 C-N-CA 122.699 2.266 . . . . 0.0 113.085 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -58.54 150.38 69.34 Favored 'Trans proline' 0 C--O 1.247 0.926 0 C-N-CA 123.153 2.569 . . . . 0.0 111.952 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.9 t -83.89 72.5 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.776 0 CA-C-O 121.519 0.675 . . . . 0.0 110.325 -177.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 174.49 32.92 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 125.989 1.715 . . . . 0.0 107.161 178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.35 161.51 41.22 Favored Pre-proline 0 C--N 1.3 -1.554 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.397 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -77.13 -142.64 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.167 0 C-N-CA 122.916 2.411 . . . . 0.0 109.773 173.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -67.97 157.84 85.59 Favored Pre-proline 0 C--N 1.301 -1.523 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -56.72 138.74 86.45 Favored 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.495 2.13 . . . . 0.0 112.028 -178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -126.26 90.9 3.26 Favored 'General case' 0 N--CA 1.421 -1.922 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.466 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.646 HG11 ' HZ1' ' A' ' 69' ' ' LYS . 9.3 t -104.53 154.73 6.16 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.596 ' HA ' ' OH ' ' A' ' 50' ' ' TYR . 8.0 t -129.34 166.28 19.82 Favored 'General case' 0 N--CA 1.414 -2.243 0 C-N-CA 119.695 -0.802 . . . . 0.0 110.601 -176.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -140.97 159.32 42.47 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 124.091 0.956 . . . . 0.0 109.18 -174.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -106.47 144.86 32.55 Favored 'General case' 0 C--N 1.31 -1.141 0 O-C-N 123.284 0.365 . . . . 0.0 110.149 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.1 mt -65.48 150.31 48.58 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-O 120.781 0.324 . . . . 0.0 111.07 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 68.75 19.23 8.52 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 125.362 1.465 . . . . 0.0 111.536 179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.62 141.25 33.75 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.317 -1.364 . . . . 0.0 107.317 175.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 39.4 m-20 -90.47 133.13 35.24 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.7 m -144.09 155.0 15.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.31 0 C-N-CA 124.009 0.924 . . . . 0.0 110.767 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.506 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 40.7 m-85 -87.51 139.76 30.22 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 175.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.494 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.51 123.93 69.64 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.943 0 C-N-CA 123.487 0.715 . . . . 0.0 110.122 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.554 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 82.5 tttt -90.18 127.1 36.03 Favored 'General case' 0 C--N 1.289 -2.038 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.51 178.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 36' ' ' ARG . 28.2 p -93.31 173.76 7.55 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 174.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -61.83 -23.59 66.35 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.78 0.324 . . . . 0.0 111.839 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -75.85 -11.63 60.01 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.47 0.652 . . . . 0.0 110.672 178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.85 5.99 60.83 Favored Glycine 0 CA--C 1.508 -0.345 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.568 178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 20.1 mmt180 -85.44 143.41 28.59 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.554 ' CZ ' ' HB2' ' A' ' 31' ' ' LYS . 13.4 m-85 -106.05 129.25 54.19 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 123.768 0.667 . . . . 0.0 110.477 174.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -116.1 124.39 50.26 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.331 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 24.8 tp -78.91 121.58 25.04 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -137.99 171.04 23.52 Favored Glycine 0 N--CA 1.438 -1.182 0 O-C-N 123.505 0.503 . . . . 0.0 111.952 -177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 10.1 m -112.56 129.71 56.27 Favored 'General case' 0 C--N 1.303 -1.433 0 C-N-CA 123.206 0.602 . . . . 0.0 109.465 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.548 HG12 HD12 ' A' ' 52' ' ' ILE . 23.4 mt -73.6 136.5 25.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 O-C-N 121.706 -0.621 . . . . 0.0 110.819 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.852 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -117.47 -32.54 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.173 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 177.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -146.73 157.25 43.64 Favored 'General case' 0 C--N 1.314 -0.943 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -143.18 142.5 31.46 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-O 120.937 0.399 . . . . 0.0 111.078 -177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 66.3 p -116.36 -174.17 2.51 Favored 'General case' 0 C--N 1.281 -2.402 0 N-CA-C 106.781 -1.563 . . . . 0.0 106.781 173.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 22.6 t -76.78 -12.56 60.0 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-O 121.278 0.561 . . . . 0.0 110.094 179.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.605 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 12.1 m-20 -116.44 -42.64 2.99 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -126.75 166.11 18.01 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-O 121.51 0.671 . . . . 0.0 112.12 -170.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.596 ' OH ' ' HA ' ' A' ' 21' ' ' THR . 96.4 m-85 -127.53 129.97 48.3 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.24 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.758 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.3 tp -83.9 116.78 22.94 Favored 'General case' 0 CA--C 1.49 -1.351 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 179.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.567 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 18.3 mm -110.97 131.14 63.0 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.847 0 O-C-N 123.349 0.406 . . . . 0.0 110.218 -177.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.852 ' HB2' HD12 ' A' ' 43' ' ' ILE . 28.4 ttp180 -105.93 117.38 33.87 Favored 'General case' 0 N--CA 1.424 -1.769 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -87.69 179.39 6.52 Favored 'General case' 0 C--N 1.283 -2.321 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.951 -177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -59.17 -32.63 70.07 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -175.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -85.05 9.63 14.2 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 122.042 0.925 . . . . 0.0 109.673 179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 70.3 18.51 6.78 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 124.85 1.26 . . . . 0.0 111.019 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.508 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 4.9 m -70.14 128.74 37.33 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 114.328 -1.305 . . . . 0.0 107.961 175.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.567 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 44.8 mt-10 -115.1 127.36 55.54 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -138.0 148.55 45.27 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -89.3 115.15 26.57 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 33.4 m -117.44 145.11 44.37 Favored 'General case' 0 C--N 1.287 -2.114 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.366 -175.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -70.14 156.11 92.35 Favored Pre-proline 0 C--N 1.31 -1.133 0 C-N-CA 123.405 0.682 . . . . 0.0 110.27 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.695 ' HA ' HD12 ' A' ' 67' ' ' LEU . 30.8 Cg_endo -67.01 -20.73 50.46 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 122.589 2.193 . . . . 0.0 110.313 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -63.29 -30.37 71.52 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.99 -1.459 . . . . 0.0 111.195 173.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 48.0 mmtm -93.24 -7.36 45.33 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -173.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.695 HD12 ' HA ' ' A' ' 64' ' ' PRO . 1.6 mt -99.94 142.27 31.64 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-O 120.811 0.339 . . . . 0.0 111.127 -175.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mmt-85 -130.79 130.39 43.64 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.61 175.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.646 ' HZ1' HG11 ' A' ' 20' ' ' VAL . 10.5 mptt -71.82 137.32 47.49 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 32.4 mt -73.67 -32.56 64.04 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.449 0.643 . . . . 0.0 109.488 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -122.3 119.82 4.11 Favored Glycine 0 N--CA 1.418 -2.524 0 N-CA-C 110.351 -1.1 . . . . 0.0 110.351 177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 78.05 38.22 27.0 Favored Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.87 90.38 0.87 Allowed Glycine 0 N--CA 1.426 -1.969 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.254 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 13.2 m -80.02 -39.38 30.02 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.7 m . . . . . 0 N--CA 1.426 -1.648 0 N-CA-C 104.997 -2.223 . . . . 0.0 104.997 177.508 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.876 0 N-CA-C 110.745 -0.942 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -86.43 77.23 9.5 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 45.8 tpp 166.92 103.7 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 127.172 2.189 . . . . 0.0 106.489 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -150.73 140.42 13.82 Favored Pre-proline 0 C--N 1.296 -1.755 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 -176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -53.43 121.98 10.44 Favored 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 122.614 2.209 . . . . 0.0 110.301 174.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.71 44.81 0.65 Allowed 'Trans proline' 0 N--CA 1.488 1.155 0 C-N-CA 123.728 2.952 . . . . 0.0 113.656 -177.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.4 p -155.31 139.12 8.31 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.22 70.28 10.09 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 122.007 0.908 . . . . 0.0 110.539 178.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.54 ' HB3' ' HD3' ' A' ' 16' ' ' PRO . . . -130.85 -54.6 0.03 OUTLIER Pre-proline 0 C--N 1.297 -1.681 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.479 178.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.54 ' HD3' ' HB3' ' A' ' 15' ' ' ALA . 62.3 Cg_endo -93.93 168.59 2.01 Favored 'Trans proline' 0 N--CA 1.441 -1.576 0 C-N-CA 121.549 1.5 . . . . 0.0 109.883 173.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 33.0 t -97.35 114.15 64.37 Favored Pre-proline 0 C--N 1.291 -1.954 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -68.33 136.54 37.35 Favored 'Trans proline' 0 C--O 1.252 1.185 0 C-N-CA 121.05 1.167 . . . . 0.0 110.161 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 173.88 140.68 0.04 OUTLIER 'General case' 0 N--CA 1.435 -1.198 0 C-N-CA 124.088 0.955 . . . . 0.0 108.552 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.59 131.44 71.35 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 172.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 12.0 t -125.2 153.11 43.61 Favored 'General case' 0 N--CA 1.412 -2.329 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.581 ' CE2' ' HE2' ' A' ' 69' ' ' LYS . 94.2 m-85 -134.92 156.41 49.03 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.314 -173.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.1 155.96 33.31 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 25.9 mt -65.36 153.56 40.85 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 70.64 8.13 6.47 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 124.61 1.164 . . . . 0.0 111.45 177.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.5 tp10 -89.23 141.27 28.67 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.1 m-20 -98.9 127.57 44.85 Favored 'General case' 0 CA--C 1.496 -1.1 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.487 HG13 ' HG3' ' A' ' 26' ' ' GLU . 6.9 m -143.3 164.12 15.97 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 C-N-CA 123.1 0.56 . . . . 0.0 111.306 -173.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' HB3' ' CD2' ' A' ' 37' ' ' PHE . 41.7 m-85 -95.9 139.64 31.82 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.69 175.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.521 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.21 121.21 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.353 0 C-N-CA 123.79 0.836 . . . . 0.0 108.934 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.615 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 80.7 tttt -88.38 132.64 34.36 Favored 'General case' 0 C--N 1.274 -2.71 0 CA-C-N 114.077 -1.419 . . . . 0.0 111.065 -179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.52 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 47.6 t -90.87 174.07 7.65 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 170.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -58.45 -35.32 71.95 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 113.062 0.764 . . . . 0.0 113.062 -173.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -80.52 5.49 15.13 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.23 7.22 65.76 Favored Glycine 0 CA--C 1.502 -0.762 0 C-N-CA 119.649 -1.263 . . . . 0.0 111.999 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -77.56 126.81 31.47 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 -177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.624 ' CD2' ' HB3' ' A' ' 29' ' ' PHE . 19.0 m-85 -104.68 135.51 45.93 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-O 121.652 0.739 . . . . 0.0 111.063 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -118.84 133.22 55.98 Favored 'General case' 0 C--N 1.292 -1.898 0 N-CA-C 106.951 -1.499 . . . . 0.0 106.951 175.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.412 HD23 ' N ' ' A' ' 40' ' ' GLY . 3.3 tt -90.6 133.5 35.06 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.247 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.412 ' N ' HD23 ' A' ' 39' ' ' LEU . . . -149.95 170.43 30.02 Favored Glycine 0 N--CA 1.427 -1.94 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.298 179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -107.77 130.09 54.99 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 123.775 0.83 . . . . 0.0 109.302 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.572 HG12 HD12 ' A' ' 52' ' ' ILE . 30.8 mt -73.44 132.82 32.83 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 O-C-N 122.026 -0.421 . . . . 0.0 110.463 -179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.848 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -114.68 -28.27 2.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.264 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 178.879 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -151.69 157.92 42.72 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -177.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -141.69 145.68 35.19 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-N 118.304 0.502 . . . . 0.0 112.14 -176.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.4 p -121.28 -176.02 3.19 Favored 'General case' 0 N--CA 1.426 -1.637 0 N-CA-C 107.629 -1.248 . . . . 0.0 107.629 173.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.1 t -77.45 -24.96 50.21 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-O 121.367 0.604 . . . . 0.0 109.78 178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -100.15 -34.19 10.14 Favored 'General case' 0 CA--C 1.499 -1.008 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.419 ' NE2' ' HB3' ' A' ' 61' ' ' TRP . 24.1 mt-30 -138.65 173.45 11.57 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 121.7 0.762 . . . . 0.0 112.707 -171.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.418 ' HB2' HD11 ' A' ' 67' ' ' LEU . 87.7 m-85 -131.9 134.98 46.29 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 114.973 -1.012 . . . . 0.0 108.814 176.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.756 ' HG ' HD11 ' A' ' 43' ' ' ILE . 32.5 tp -87.31 117.56 26.15 Favored 'General case' 0 CA--C 1.486 -1.511 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.614 HD11 HD21 ' A' ' 67' ' ' LEU . 17.1 mm -111.0 133.49 56.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.925 0 O-C-N 123.641 0.588 . . . . 0.0 110.176 -177.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.848 ' HB2' HD12 ' A' ' 43' ' ' ILE . 41.0 ttm180 -107.64 116.13 31.39 Favored 'General case' 0 N--CA 1.416 -2.138 0 N-CA-C 107.362 -1.348 . . . . 0.0 107.362 175.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -83.37 177.99 8.24 Favored 'General case' 0 C--N 1.28 -2.433 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.948 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.12 -29.02 70.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.287 0.565 . . . . 0.0 110.938 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -85.09 11.75 9.1 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.113 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 70.84 8.4 6.53 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 125.678 1.591 . . . . 0.0 114.089 173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.584 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 18.8 p -77.25 145.97 37.2 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.539 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 42.5 mt-10 -114.41 130.6 56.71 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -139.84 141.74 36.65 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.419 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . 91.2 m95 -89.26 110.29 21.08 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 177.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 26.8 m -115.06 147.1 40.59 Favored 'General case' 0 C--N 1.295 -1.773 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.413 -174.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -70.26 149.02 95.94 Favored Pre-proline 0 C--N 1.318 -0.795 0 C-N-CA 122.78 0.432 . . . . 0.0 110.067 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.708 ' HA ' HD12 ' A' ' 67' ' ' LEU . 16.7 Cg_exo -55.87 -28.33 67.37 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 123.237 2.625 . . . . 0.0 113.333 178.473 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -73.01 -27.03 61.54 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 121.482 0.658 . . . . 0.0 111.778 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.453 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 42.3 mmtm -78.74 -17.66 55.47 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -92.44 140.32 29.7 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.784 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.5 mmt180 -138.82 136.9 36.12 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HE2' ' CE2' ' A' ' 22' ' ' TYR . 0.2 OUTLIER -71.13 153.95 42.11 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.802 179.011 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.445 HD22 ' CE1' ' A' ' 29' ' ' PHE . 15.4 mt -83.23 -33.41 26.1 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.739 -177.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -119.14 48.6 0.93 Allowed Glycine 0 N--CA 1.438 -1.195 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.078 -177.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.24 -69.44 3.27 Favored Glycine 0 N--CA 1.441 -0.993 0 N-CA-C 111.914 -0.475 . . . . 0.0 111.914 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -127.53 -167.82 12.37 Favored Glycine 0 N--CA 1.429 -1.773 0 N-CA-C 110.789 -0.924 . . . . 0.0 110.789 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.2 m -119.81 139.22 52.68 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--N 1.294 -1.845 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 177.341 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.887 0 N-CA-C 109.908 -1.277 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 45.9 85.13 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.456 1.102 . . . . 0.0 112.393 179.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 27.0 ptm -76.55 140.51 41.13 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.174 0.511 . . . . 0.0 110.926 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -122.12 104.03 38.66 Favored Pre-proline 0 C--N 1.296 -1.731 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -77.93 111.91 3.18 Favored 'Trans proline' 0 C--O 1.245 0.826 0 C-N-CA 122.208 1.939 . . . . 0.0 112.519 -179.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_exo -64.86 -48.0 4.39 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.409 2.073 . . . . 0.0 110.798 178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.8 m -126.97 111.6 26.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.041 176.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.75 177.76 3.27 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.6 -52.66 63.47 Favored Pre-proline 0 C--N 1.313 -1.009 0 O-C-N 123.335 0.397 . . . . 0.0 111.787 177.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -89.29 159.43 5.6 Favored 'Trans proline' 0 N--CA 1.446 -1.281 0 C-N-CA 121.173 1.249 . . . . 0.0 111.218 174.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 78.2 p -115.18 160.81 32.6 Favored Pre-proline 0 C--N 1.291 -1.938 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -63.26 138.6 67.36 Favored 'Trans proline' 0 C--O 1.242 0.697 0 C-N-CA 121.446 1.431 . . . . 0.0 110.286 175.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 58.35 83.86 0.11 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.136 0.974 . . . . 0.0 111.779 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.564 HG23 ' CE1' ' A' ' 22' ' ' TYR . 10.5 m -85.41 166.17 2.1 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.949 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 14.5 p -104.25 155.55 18.65 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.537 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.564 ' CE1' HG23 ' A' ' 20' ' ' VAL . 64.9 m-85 -131.45 158.88 39.65 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.06 -175.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.96 152.27 34.94 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.742 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 43.8 mt -64.92 158.44 25.31 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 110.597 -0.149 . . . . 0.0 110.597 178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 70.3 1.48 3.6 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.782 1.233 . . . . 0.0 112.249 178.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -88.59 141.32 28.62 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 178.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 18.5 m-20 -97.24 128.3 43.98 Favored 'General case' 0 CA--C 1.492 -1.277 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -178.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -143.69 155.7 16.19 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.306 -173.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' ILE . 40.6 m-85 -87.94 139.93 30.02 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 175.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 37' ' ' PHE . 1.7 mp -122.0 123.58 69.37 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 C-N-CA 123.847 0.859 . . . . 0.0 110.254 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 81.2 tttt -85.56 124.04 31.66 Favored 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.109 177.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.4 p -90.87 174.46 7.43 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 115.205 -0.907 . . . . 0.0 108.557 175.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -59.69 -30.55 68.86 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.647 0.26 . . . . 0.0 111.539 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -74.65 -11.41 60.18 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.459 0.647 . . . . 0.0 111.023 -179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 97.2 -1.43 60.71 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 121.153 -0.546 . . . . 0.0 113.057 177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -81.87 145.45 30.36 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 -178.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 30' ' ' ILE . 13.7 m-85 -105.54 129.69 53.76 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 123.744 0.653 . . . . 0.0 110.481 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.34 127.73 55.61 Favored 'General case' 0 C--N 1.295 -1.78 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.385 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 28.0 tp -83.97 120.48 26.16 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 120.88 0.371 . . . . 0.0 111.044 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -142.61 174.16 23.6 Favored Glycine 0 N--CA 1.441 -1.029 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.763 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 11.8 m -109.42 134.82 51.38 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 -178.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.521 HG12 HD12 ' A' ' 52' ' ' ILE . 25.0 mt -75.92 129.86 36.7 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 O-C-N 122.059 -0.401 . . . . 0.0 110.237 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.746 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -109.67 -30.59 2.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.171 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -147.43 158.16 43.87 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 -176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -140.66 144.5 35.72 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-O 120.938 0.399 . . . . 0.0 110.961 -175.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.3 p -115.84 -165.57 1.05 Allowed 'General case' 0 C--N 1.288 -2.069 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 171.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 35.9 m -75.5 -22.14 57.42 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.498 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HD3' ' A' ' 64' ' ' PRO . 23.7 t70 -121.71 -38.81 2.7 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.283 -179.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -107.47 164.13 12.47 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 121.951 0.882 . . . . 0.0 112.979 -171.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -131.24 131.38 43.87 Favored 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.244 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.586 ' HG ' HD11 ' A' ' 43' ' ' ILE . 35.4 tp -86.42 116.66 24.71 Favored 'General case' 0 CA--C 1.491 -1.313 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.565 HD11 HD21 ' A' ' 67' ' ' LEU . 14.5 mm -110.5 132.33 59.18 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.987 0 O-C-N 123.218 0.323 . . . . 0.0 110.426 -174.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.746 ' HB2' HD12 ' A' ' 43' ' ' ILE . 52.7 ttp180 -102.31 116.5 32.76 Favored 'General case' 0 N--CA 1.426 -1.648 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 176.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -85.91 177.61 7.56 Favored 'General case' 0 C--N 1.276 -2.608 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.647 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -67.21 -19.28 65.53 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.436 0.636 . . . . 0.0 111.041 -177.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -84.24 7.24 19.8 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.31 177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 63.96 21.64 12.69 Favored 'General case' 0 C--O 1.228 -0.044 0 C-N-CA 124.483 1.113 . . . . 0.0 111.187 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 33.1 t -90.96 145.32 24.81 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 176.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.538 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 47.6 mt-10 -118.32 127.93 54.17 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -134.61 145.58 48.77 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -89.02 115.68 26.75 Favored 'General case' 0 CA--C 1.499 -1.018 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 175.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 35.4 m -121.09 143.59 49.0 Favored 'General case' 0 C--N 1.289 -2.028 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.815 -176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 64' ' ' PRO . 1.5 mp0 -75.37 156.9 85.22 Favored Pre-proline 0 C--N 1.318 -0.798 0 O-C-N 123.513 0.508 . . . . 0.0 111.655 178.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.706 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.6 Cg_endo -64.58 -23.15 64.3 Favored 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.825 2.35 . . . . 0.0 114.47 -172.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -73.56 -18.68 61.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.996 0.427 . . . . 0.0 110.906 176.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.0 mmtm -87.91 -14.38 39.45 Favored 'General case' 0 CA--C 1.497 -1.091 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.218 -178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.706 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.3 mt -98.92 138.45 36.02 Favored 'General case' 0 C--N 1.291 -1.946 0 CA-C-N 115.069 -0.968 . . . . 0.0 109.045 -176.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 67' ' ' LEU . 26.2 mmm180 -132.9 138.53 47.0 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 176.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.45 ' HE3' HG21 ' A' ' 20' ' ' VAL . 0.3 OUTLIER -73.14 149.61 42.86 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 27' ' ' ASP . 31.2 mt -80.9 -33.41 34.25 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.543 -0.863 . . . . 0.0 109.402 178.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -144.47 149.76 21.84 Favored Glycine 0 N--CA 1.424 -2.164 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 90.86 -100.14 2.65 Favored Glycine 0 N--CA 1.425 -2.061 0 N-CA-C 110.416 -1.074 . . . . 0.0 110.416 -177.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 117.06 -55.74 0.55 Allowed Glycine 0 CA--C 1.49 -1.495 0 N-CA-C 110.086 -1.205 . . . . 0.0 110.086 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.0 m -76.14 -21.39 56.64 Favored 'General case' 0 C--N 1.309 -1.177 0 N-CA-C 108.407 -0.961 . . . . 0.0 108.407 174.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 N--CA 1.42 -1.934 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 175.827 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.493 -1.323 0 N-CA-C 111.213 -0.755 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 63.45 90.23 0.08 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.529 1.132 . . . . 0.0 111.576 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 13.7 tpt 65.94 25.21 11.11 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-O 122.663 1.22 . . . . 0.0 109.593 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -132.93 122.67 17.67 Favored Pre-proline 0 C--N 1.317 -0.818 0 CA-C-N 114.587 -1.188 . . . . 0.0 108.214 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -58.74 120.54 8.48 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.303 2.668 . . . . 0.0 113.943 -175.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -64.4 -46.23 7.88 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 122.683 2.255 . . . . 0.0 110.409 176.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.9 t -101.37 152.5 5.19 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 107.286 -1.376 . . . . 0.0 107.286 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -48.4 119.62 3.13 Favored 'General case' 0 C--O 1.248 0.996 0 C-N-CA 124.076 0.95 . . . . 0.0 111.998 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.464 ' HB1' ' HD2' ' A' ' 16' ' ' PRO . . . -146.29 174.52 3.35 Favored Pre-proline 0 C--N 1.305 -1.332 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 -176.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.464 ' HD2' ' HB1' ' A' ' 15' ' ' ALA . 11.2 Cg_endo -55.92 -179.42 0.08 OUTLIER 'Trans proline' 0 CA--C 1.551 1.369 0 C-N-CA 123.097 2.531 . . . . 0.0 112.736 172.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 t -77.02 125.82 86.32 Favored Pre-proline 0 C--N 1.302 -1.475 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -178.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -66.06 137.92 50.21 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.051 1.834 . . . . 0.0 110.529 -179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -109.73 88.61 2.79 Favored 'General case' 0 N--CA 1.42 -1.928 0 CA-C-O 121.501 0.667 . . . . 0.0 111.83 -175.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.1 m -89.09 157.97 3.0 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.502 0 CA-C-N 114.637 -1.165 . . . . 0.0 108.584 172.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.3 p -126.02 155.93 40.69 Favored 'General case' 0 C--N 1.278 -2.541 0 O-C-N 123.247 0.342 . . . . 0.0 111.796 -178.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.474 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 96.3 m-85 -139.87 151.35 45.58 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.003 -177.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -107.38 150.59 26.56 Favored 'General case' 0 C--N 1.318 -0.787 0 O-C-N 123.734 0.646 . . . . 0.0 109.635 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.47 155.9 34.12 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-O 120.9 0.381 . . . . 0.0 111.796 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 67.78 17.03 9.77 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 125.553 1.541 . . . . 0.0 111.033 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -101.46 141.98 33.52 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.093 178.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -94.05 125.45 38.68 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.9 m -142.27 152.42 18.22 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 123.864 0.865 . . . . 0.0 110.351 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.6 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 30.0 m-85 -84.89 139.4 31.89 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.496 ' HA ' ' O ' ' A' ' 66' ' ' LYS . 1.7 mp -122.68 124.32 70.33 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.125 0 C-N-CA 124.414 1.086 . . . . 0.0 108.71 178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.509 ' HB2' ' CE1' ' A' ' 37' ' ' PHE . 83.4 tttt -89.08 127.6 35.71 Favored 'General case' 0 C--N 1.286 -2.171 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.922 178.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 53.3 t -88.46 164.83 15.28 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.15 -1.055 . . . . 0.0 108.15 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -60.0 -21.87 61.84 Favored 'General case' 0 C--N 1.311 -1.073 0 C-N-CA 123.562 0.745 . . . . 0.0 112.068 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.409 ' OD2' ' HD3' ' A' ' 36' ' ' ARG . 36.1 t70 -79.56 -11.91 59.87 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-O 121.737 0.78 . . . . 0.0 110.829 178.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 103.1 -9.31 54.52 Favored Glycine 0 N--CA 1.442 -0.902 0 C-N-CA 121.133 -0.556 . . . . 0.0 113.369 177.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.409 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 9.1 mpt_? -78.01 144.77 36.41 Favored 'General case' 0 C--N 1.312 -1.062 0 C-N-CA 120.171 -0.611 . . . . 0.0 111.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 7.0 m-85 -104.41 131.48 51.72 Favored 'General case' 0 N--CA 1.427 -1.595 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.317 176.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -117.03 128.18 54.91 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.226 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' CE2' ' A' ' 29' ' ' PHE . 29.1 tp -85.96 115.05 23.33 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.62 170.19 21.16 Favored Glycine 0 N--CA 1.431 -1.68 0 C-N-CA 120.56 -0.828 . . . . 0.0 112.173 -177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 13.9 m -113.1 128.41 56.48 Favored 'General case' 0 C--N 1.297 -1.704 0 N-CA-C 108.666 -0.865 . . . . 0.0 108.666 -178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.549 HG12 HD12 ' A' ' 52' ' ' ILE . 28.2 mt -72.71 134.08 30.5 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 O-C-N 122.327 -0.233 . . . . 0.0 111.117 -177.073 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.794 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.1 OUTLIER -113.77 -30.33 2.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 178.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -148.74 156.97 43.09 Favored 'General case' 0 CA--C 1.501 -0.941 0 C-N-CA 120.243 -0.583 . . . . 0.0 109.647 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.17 142.63 44.18 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 121.357 0.598 . . . . 0.0 111.82 -178.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 44.2 p -117.0 -176.6 3.02 Favored 'General case' 0 N--CA 1.418 -2.072 0 N-CA-C 105.963 -1.865 . . . . 0.0 105.963 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 25.2 m -77.05 -22.34 53.09 Favored 'General case' 0 C--N 1.291 -1.976 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.892 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -114.66 -23.64 9.14 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 119.756 -0.778 . . . . 0.0 112.283 -177.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -136.9 160.1 39.89 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -176.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -123.61 134.76 53.74 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.755 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.653 ' HG ' HD11 ' A' ' 43' ' ' ILE . 34.5 tp -88.21 115.15 25.49 Favored 'General case' 0 CA--C 1.494 -1.173 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.56 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 12.7 mm -110.52 131.59 61.22 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 O-C-N 123.57 0.544 . . . . 0.0 110.157 -176.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.794 ' HB2' HD12 ' A' ' 43' ' ' ILE . 34.4 ttt85 -102.57 116.24 32.19 Favored 'General case' 0 CA--C 1.482 -1.637 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 175.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -81.44 178.17 8.53 Favored 'General case' 0 C--N 1.262 -3.236 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.186 -177.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -63.98 -30.24 71.33 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.753 0.787 . . . . 0.0 109.507 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -84.59 12.09 7.68 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 114.522 -1.217 . . . . 0.0 109.859 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 67.89 8.09 6.21 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.095 1.758 . . . . 0.0 114.078 171.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 54.7 m -80.8 141.78 34.38 Favored 'General case' 0 C--N 1.305 -1.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 58.5 mt-10 -115.61 121.99 44.26 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -135.82 146.55 47.63 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.523 -175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -88.88 112.99 23.94 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 30.9 m -116.9 154.52 30.66 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.168 -176.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -71.03 149.18 94.72 Favored Pre-proline 0 C--N 1.31 -1.133 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.251 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.696 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.2 Cg_exo -60.52 -26.25 82.41 Favored 'Trans proline' 0 CA--C 1.535 0.538 0 C-N-CA 123.027 2.484 . . . . 0.0 110.089 174.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -62.74 -30.91 71.79 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 114.252 -1.34 . . . . 0.0 111.443 174.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.9 mmtm -90.14 -10.89 42.89 Favored 'General case' 0 CA--C 1.498 -1.045 0 O-C-N 122.033 -0.417 . . . . 0.0 111.852 -176.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.6 mt -93.68 139.08 31.23 Favored 'General case' 0 C--N 1.29 -1.985 0 O-C-N 123.96 0.788 . . . . 0.0 109.753 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 32.8 mmm180 -132.77 131.74 41.47 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.14 133.21 48.55 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 174.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 47.0 mt -72.42 -34.38 67.79 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-O 120.802 0.334 . . . . 0.0 111.425 -172.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -110.85 25.19 15.03 Favored Glycine 0 CA--C 1.489 -1.558 0 C-N-CA 120.509 -0.853 . . . . 0.0 111.889 -176.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.63 -60.81 4.55 Favored Glycine 0 C--N 1.313 -0.706 0 C-N-CA 121.377 -0.44 . . . . 0.0 112.034 -179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -129.64 130.42 6.32 Favored Glycine 0 N--CA 1.427 -1.917 0 N-CA-C 110.676 -0.97 . . . . 0.0 110.676 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.7 p -164.43 44.81 0.1 Allowed 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.435 -1.214 0 CA-C-N 113.476 -1.693 . . . . 0.0 107.751 -169.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.81 0 N-CA-C 111.038 -0.825 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 65.77 151.28 0.05 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.184 1.394 . . . . 0.0 112.384 -178.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . 0.424 ' HG2' ' HB ' ' A' ' 21' ' ' THR . 25.8 ptt? -136.24 168.36 19.56 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.3 150.95 74.05 Favored Pre-proline 0 C--N 1.288 -2.068 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 177.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.6 125.92 17.87 Favored 'Trans proline' 0 C--O 1.244 0.794 0 C-N-CA 122.001 1.801 . . . . 0.0 110.062 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -50.24 -54.54 5.29 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 123.197 2.598 . . . . 0.0 111.173 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.455 ' O ' ' HD2' ' A' ' 16' ' ' PRO . 59.3 t -103.16 130.65 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 172.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.21 84.78 4.41 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.684 0.754 . . . . 0.0 111.337 -177.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.528 ' H ' ' HD2' ' A' ' 16' ' ' PRO . . . -150.0 -53.16 0.02 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.923 178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.528 ' HD2' ' H ' ' A' ' 15' ' ' ALA . 32.5 Cg_endo -64.37 166.37 17.4 Favored 'Trans proline' 0 C--N 1.38 2.215 0 C-N-CA 122.185 1.923 . . . . 0.0 110.809 172.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 19.6 m -87.42 133.95 37.25 Favored Pre-proline 0 C--N 1.292 -1.918 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.993 -177.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 17' ' ' SER . 33.4 Cg_exo -63.64 148.81 92.06 Favored 'Trans proline' 0 C--O 1.256 1.39 0 C-N-CA 122.819 2.346 . . . . 0.0 110.367 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -150.63 -168.67 3.17 Favored 'General case' 0 N--CA 1.41 -2.46 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.7 m -76.01 157.87 5.62 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.181 0 CA-C-N 114.748 -1.114 . . . . 0.0 110.125 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.424 ' HB ' ' HG2' ' A' ' 9' ' ' MET . 12.4 t -138.24 155.12 48.95 Favored 'General case' 0 C--N 1.29 -1.993 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -177.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.436 ' HB3' ' CD1' ' A' ' 42' ' ' ILE . 95.1 m-85 -138.42 155.51 48.42 Favored 'General case' 0 C--N 1.297 -1.714 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.48 -178.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.09 163.56 13.47 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.745 179.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.25 159.2 27.05 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 174.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 69.26 6.47 5.69 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.329 1.052 . . . . 0.0 111.628 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.403 ' HG3' HG13 ' A' ' 28' ' ' VAL . 10.4 tp10 -87.31 130.9 34.44 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -92.4 125.36 37.02 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 175.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.408 HG11 ' CD1' ' A' ' 22' ' ' TYR . 4.1 m -143.41 157.55 16.99 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.779 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.714 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.557 ' HB3' ' CD1' ' A' ' 37' ' ' PHE . 31.3 m-85 -89.38 139.44 30.51 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.607 176.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.508 HD12 ' C ' ' A' ' 29' ' ' PHE . 1.7 mp -122.86 124.51 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.256 0 C-N-CA 123.505 0.722 . . . . 0.0 109.32 179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HA ' ' O ' ' A' ' 36' ' ' ARG . 81.1 tttt -90.15 128.9 36.46 Favored 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.861 176.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 49.9 t -96.96 172.34 7.92 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -66.26 -17.96 65.06 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.561 0.696 . . . . 0.0 110.422 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -72.52 -11.94 60.87 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.99 176.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 89.19 6.77 70.91 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 114.669 0.628 . . . . 0.0 114.669 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.491 ' O ' ' HA ' ' A' ' 31' ' ' LYS . 9.0 mpt_? -96.99 158.31 15.49 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 117.74 0.77 . . . . 0.0 110.4 176.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.557 ' CD1' ' HB3' ' A' ' 29' ' ' PHE . 11.9 m-85 -105.58 129.08 53.91 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.313 173.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -115.37 124.72 51.95 Favored 'General case' 0 C--N 1.282 -2.354 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.473 ' HB2' ' CE1' ' A' ' 29' ' ' PHE . 28.7 tp -85.96 120.6 27.53 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 120.773 0.32 . . . . 0.0 110.431 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -139.09 170.46 24.06 Favored Glycine 0 N--CA 1.436 -1.314 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.948 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 19.0 m -108.58 130.5 55.3 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.504 HG12 ' CD1' ' A' ' 52' ' ' ILE . 27.2 mt -71.09 131.7 34.17 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 122.291 -0.255 . . . . 0.0 110.803 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.669 HD12 ' HB2' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -110.4 -32.2 2.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 179.111 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -147.79 151.91 36.81 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.51 164.31 26.88 Favored 'General case' 0 C--N 1.286 -2.193 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.331 -178.538 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 25.0 p -142.17 -178.26 5.63 Favored 'General case' 0 C--N 1.294 -1.804 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 174.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.4 p -74.52 -13.26 60.66 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -132.68 -20.7 2.27 Favored 'General case' 0 C--N 1.319 -0.726 0 C-N-CA 119.738 -0.785 . . . . 0.0 112.275 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -134.74 163.36 29.95 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 120.974 0.416 . . . . 0.0 110.955 -178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -131.39 131.6 43.77 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.585 176.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.499 ' HG ' HD11 ' A' ' 43' ' ' ILE . 31.4 tp -89.0 113.84 24.97 Favored 'General case' 0 CA--C 1.494 -1.196 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 -179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 59' ' ' GLU . 13.1 mm -110.11 135.19 49.9 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.911 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.628 -174.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.669 ' HB2' HD12 ' A' ' 43' ' ' ILE . 54.9 ttp180 -103.4 116.73 32.96 Favored 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 176.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -88.47 178.58 6.5 Favored 'General case' 0 C--N 1.278 -2.528 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.033 -177.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -66.37 -22.85 66.26 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.764 0.793 . . . . 0.0 110.351 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -84.59 7.89 18.6 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-O 122.059 0.933 . . . . 0.0 109.749 176.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 67.83 8.22 6.28 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.365 1.466 . . . . 0.0 112.847 175.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' ARG . 68.5 m -83.01 148.27 27.67 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.526 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 46.4 mt-10 -114.45 137.0 52.39 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 tp60 -146.25 143.48 29.23 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 97.1 m95 -88.64 112.54 23.21 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 23.9 m -114.97 154.16 29.29 Favored 'General case' 0 C--N 1.289 -2.054 0 CA-C-N 115.038 -0.983 . . . . 0.0 109.424 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -73.38 151.59 89.81 Favored Pre-proline 0 C--N 1.312 -1.064 0 O-C-N 123.621 0.576 . . . . 0.0 110.305 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.664 ' HA ' HD12 ' A' ' 67' ' ' LEU . 12.7 Cg_exo -60.19 -22.69 71.23 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.056 2.504 . . . . 0.0 110.53 173.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -62.82 -33.16 74.65 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.945 1.298 . . . . 0.0 111.855 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 30' ' ' ILE . 47.2 mmtm -89.62 -14.4 35.05 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.567 -176.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.664 HD12 ' HA ' ' A' ' 64' ' ' PRO . 2.2 mt -92.57 134.33 35.09 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 123.813 0.696 . . . . 0.0 110.983 -178.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -131.21 138.87 49.57 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.21 150.19 45.54 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 123.505 0.503 . . . . 0.0 109.764 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 29.3 mt -81.45 -32.78 32.44 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -104.46 -112.95 3.76 Favored Glycine 0 N--CA 1.434 -1.498 0 CA-C-N 115.341 -0.845 . . . . 0.0 112.414 -179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -72.63 95.23 0.69 Allowed Glycine 0 C--O 1.243 0.672 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 142.18 34.27 0.1 Allowed Glycine 0 C--N 1.291 -1.923 0 C-N-CA 121.088 -0.577 . . . . 0.0 111.814 178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.1 t -87.86 109.27 19.64 Favored 'General case' 0 N--CA 1.418 -2.048 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 62.7 m . . . . . 0 C--N 1.287 -2.123 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 -177.276 . . . . . . . . 0 0 . 1 stop_ save_