data_2lni_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 2lni _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 ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 111.048 0.018 . . . . 75.420000000000002 111.048 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.450000000000003 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.529 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 73.319999999999993 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.519999999999996 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.546 HG12 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.230000000000004 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.529 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.219999999999999 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 74.299999999999997 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 75.310000000000002 112.279 167.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 75.439999999999998 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.119999999999997 109.708 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.510000000000005 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 64.430000000000007 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.239999999999995 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 73.209999999999994 110.333 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 72.549999999999997 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.420000000000002 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.451 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.310000000000002 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.451 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.420000000000002 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.349999999999994 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.319999999999993 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 64.140000000000001 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 74.340000000000003 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 79.7 m-70 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.439999999999998 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.329999999999998 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.430000000000007 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.310000000000002 110.148 175.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.129999999999995 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 71.510000000000005 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 74.010000000000005 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 73.129999999999995 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 53.329999999999998 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.040000000000006 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 74.109999999999999 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.731 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 72.319999999999993 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 65.409999999999997 111.716 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 74.450000000000003 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 75.409999999999997 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.439999999999998 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 73.109999999999999 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 73.010000000000005 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.420000000000002 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 75.310000000000002 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 75.420000000000002 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.099999999999994 112.975 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 74.230000000000004 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 75.530000000000001 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 73.109999999999999 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 72.319999999999993 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.430000000000007 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 74.340000000000003 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.129999999999995 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 63.140000000000001 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.150000000000006 111.546 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HE2' ' A' ' 97' ' ' MET . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 74.329999999999998 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 73.409999999999997 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.439999999999998 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.040000000000006 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 75.349999999999994 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.430000000000007 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.409999999999997 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 64.019999999999996 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.439999999999998 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.340000000000003 107.818 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 74.010000000000005 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 75.219999999999999 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.230000000000004 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.310000000000002 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 72.5 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 62.539999999999999 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.310000000000002 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.420000000000002 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.430000000000007 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.349999999999994 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.471 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.019999999999996 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.140000000000001 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 73.209999999999994 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.519999999999996 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 72.120000000000005 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 61.140000000000001 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.501 ' HE2' HD13 ' A' ' 70' ' ' LEU . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 73.409999999999997 109.901 176.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 64.040000000000006 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 74.349999999999994 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.409999999999997 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 73.430000000000007 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 75.409999999999997 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.230000000000004 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.310000000000002 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.400000000000006 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 102' ' ' LYS . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.594 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 72.200000000000003 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.540000000000006 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.409999999999997 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 75.400000000000006 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.200000000000003 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.519999999999996 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.329999999999998 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.209999999999994 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 72.409999999999997 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.549999999999997 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.329999999999998 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.150000000000006 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.450000000000003 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 73.140000000000001 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 71.219999999999999 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.209999999999994 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.040000000000006 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . 0.429 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.540000000000006 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 71.040000000000006 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 64.049999999999997 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.594 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.430000000000007 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 74.140000000000001 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.100000000000001 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 73.540000000000006 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.010000000000005 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 75.239999999999995 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 74.049999999999997 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.424 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 120.537 0.208 . . . . 75.109999999999999 110.938 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.129999999999995 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.420000000000002 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 74.310000000000002 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.6 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.200000000000003 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.140000000000001 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.450000000000003 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 61.530000000000001 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 71.510000000000005 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.049999999999997 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.420000000000002 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.430000000000007 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.239999999999995 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 71.140000000000001 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 73.030000000000001 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.553 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 75.219999999999999 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.45 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 73.010000000000005 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.45 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.310000000000002 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 73.340000000000003 111.508 -176.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 74.319999999999993 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 74.120000000000005 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.239999999999995 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.109999999999999 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 72.219999999999999 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.230000000000004 110.928 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.099999999999994 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 63.039999999999999 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 64.540000000000006 111.675 -178.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.310000000000002 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.447 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.030000000000001 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.120000000000005 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.536 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 75.439999999999998 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.447 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.030000000000001 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 73.209999999999994 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.559 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 64.519999999999996 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.019999999999996 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 75.439999999999998 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.219999999999999 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.420000000000002 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.519999999999996 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 64.230000000000004 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 74.030000000000001 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 73.239999999999995 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 74.109999999999999 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 73.329999999999998 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 74.439999999999998 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.230000000000004 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 73.420000000000002 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.430000000000007 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.549999999999997 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.340000000000003 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 74.200000000000003 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 75.239999999999995 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.420000000000002 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.467 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.030000000000001 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.499 ' HB3' ' HZ2' ' A' ' 90' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.040000000000006 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 74.340000000000003 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.430000000000007 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.140000000000001 111.19 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 74.25 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.150000000000006 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.729 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.150000000000006 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.519999999999996 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.049999999999997 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.467 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.040000000000006 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 72.049999999999997 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 72.349999999999994 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.140000000000001 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 74.439999999999998 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.418 HG21 ' HB1' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.310000000000002 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.120000000000005 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.499 ' HZ2' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 73.420000000000002 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 75.140000000000001 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.510000000000005 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.430000000000007 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 64.209999999999994 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.239999999999995 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.299999999999997 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 75.239999999999995 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 75.439999999999998 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.230000000000004 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.310000000000002 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.120000000000005 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 65.409999999999997 110.557 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 75.349999999999994 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.329999999999998 112.007 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.140000000000001 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 74.230000000000004 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.019999999999996 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.540000000000006 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 75.299999999999997 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.140000000000001 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.504 HD21 ' HB1' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 75.040000000000006 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.420000000000002 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.109999999999999 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.310000000000002 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 71.340000000000003 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.420000000000002 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.299999999999997 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 63.420000000000002 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.349999999999994 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.487 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.504 ' HB1' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 70.219999999999999 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.450000000000003 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 61.119999999999997 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . 0.458 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 72.510000000000005 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.120000000000005 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.450000000000003 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.683 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.239999999999995 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 72.010000000000005 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.430000000000007 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.439999999999998 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 75.420000000000002 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.549999999999997 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 73.340000000000003 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 75.450000000000003 109.947 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 74.549999999999997 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.593 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 73.530000000000001 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.540000000000006 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 73.340000000000003 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.593 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 73.200000000000003 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.019999999999996 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 74.450000000000003 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.209999999999994 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.421 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 62.329999999999998 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 64.540000000000006 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 73.450000000000003 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 73.299999999999997 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.239999999999995 111.555 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.329999999999998 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.540000000000006 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.406 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 74.230000000000004 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 74.209999999999994 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.010000000000005 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.430000000000007 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 75.420000000000002 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 74.519999999999996 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.450000000000003 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.421 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 65.230000000000004 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.430000000000007 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.450000000000003 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.049999999999997 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.329999999999998 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.434 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 73.0 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 74.209999999999994 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 73.409999999999997 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 72.450000000000003 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.522 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.109999999999999 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.310000000000002 111.268 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.239999999999995 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.219999999999999 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 72.349999999999994 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.409999999999997 109.805 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.340000000000003 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.400000000000006 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.340000000000003 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.120000000000005 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.439999999999998 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 73.200000000000003 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 73.430000000000007 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.329999999999998 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 73.510000000000005 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 75.340000000000003 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 75.209999999999994 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.230000000000004 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 75.019999999999996 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 74.439999999999998 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.43 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.439999999999998 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 73.439999999999998 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.409999999999997 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 73.140000000000001 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.099999999999994 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.522 ' SG ' ' HA ' ' A' ' 50' ' ' ALA . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.209999999999994 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 74.010000000000005 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 75.030000000000001 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.495 HD11 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.040000000000006 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.424 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.510000000000005 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 73.310000000000002 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 74.239999999999995 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.329999999999998 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.209999999999994 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 74.319999999999993 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.329999999999998 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 74.019999999999996 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.040000000000006 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.129999999999995 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 74.310000000000002 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.502 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.310000000000002 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.140000000000001 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.239999999999995 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.319999999999993 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 73.319999999999993 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 71.329999999999998 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 73.209999999999994 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.150000000000006 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.329999999999998 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.219999999999999 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.120000000000005 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.219999999999999 109.649 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HB1' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.200000000000003 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.434 ' HE2' ' NE2' ' A' ' 131' ' ' GLN . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 74.439999999999998 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.150000000000006 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.219999999999999 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.420000000000002 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 74.329999999999998 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 71.319999999999993 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.747 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.129999999999995 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.230000000000004 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 72.219999999999999 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.319999999999993 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.329999999999998 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 63.340000000000003 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 71.319999999999993 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.747 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 71.319999999999993 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.230000000000004 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.329999999999998 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.450000000000003 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 74.329999999999998 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.099999999999994 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 65.329999999999998 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 75.349999999999994 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.510000000000005 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 73.120000000000005 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.442 ' SG ' ' HB1' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.329999999999998 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.140000000000001 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.430000000000007 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.420000000000002 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.434 ' NE2' ' HE2' ' A' ' 104' ' ' MET . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.349999999999994 111.677 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 71.439999999999998 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 73.109999999999999 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.422 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.150000000000006 110.072 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 74.230000000000004 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.57 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.229999999999997 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 64.299999999999997 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.5 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.239999999999995 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.57 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.400000000000006 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.209999999999994 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.329999999999998 110.291 174.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.310000000000002 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 74.239999999999995 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.310000000000002 112.511 -171.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.140000000000001 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 73.129999999999995 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.549999999999997 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 75.230000000000004 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 62.039999999999999 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.030000000000001 113.019 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 71.349999999999994 111.523 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.602 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.519999999999996 111.308 -177.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 74.310000000000002 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 74.109999999999999 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.349999999999994 110.478 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.129999999999995 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.450000000000003 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 75.099999999999994 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.230000000000004 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.230000000000004 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 75.549999999999997 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.409999999999997 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.209999999999994 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.329999999999998 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.150000000000006 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 75.040000000000006 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 71.439999999999998 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.219999999999999 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.510000000000005 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD21 ' HZ2' ' A' ' 20' ' ' LYS . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.409999999999997 109.927 173.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.129999999999995 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 74.329999999999998 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 74.519999999999996 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 71.319999999999993 109.979 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.010000000000005 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 73.349999999999994 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.299999999999997 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 72.329999999999998 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 74.420000000000002 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.140000000000001 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.349999999999994 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 72.310000000000002 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.540000000000006 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.463 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 75.319999999999993 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.439999999999998 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 55.200000000000003 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 74.129999999999995 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.149999999999999 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 74.420000000000002 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.420000000000002 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.439999999999998 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.409999999999997 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.209999999999994 111.169 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' CE2' ' A' ' 83' ' ' PHE . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 72.049999999999997 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 73.430000000000007 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 65.340000000000003 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.239999999999995 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.450000000000003 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.239999999999995 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 74.329999999999998 112.702 -172.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.409999999999997 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.506 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.340000000000003 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.329999999999998 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 61.399999999999999 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 73.219999999999999 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 71.129999999999995 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 75.219999999999999 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.530000000000001 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.506 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.049999999999997 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.439999999999998 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.437 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 74.349999999999994 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.120000000000005 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 73.239999999999995 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 74.230000000000004 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 73.430000000000007 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 72.519999999999996 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 73.340000000000003 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 74.540000000000006 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 74.340000000000003 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.453 ' O ' HG21 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 74.209999999999994 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 74.329999999999998 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 75.430000000000007 111.695 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.019999999999996 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 72.319999999999993 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.634 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.409999999999997 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 74.25 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 71.450000000000003 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 87' ' ' TYR . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 60.450000000000003 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.120000000000005 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 75.099999999999994 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 65.019999999999996 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.506 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 74.129999999999995 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.200000000000003 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.430000000000007 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.455 ' SG ' ' CB ' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.310000000000002 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 75.129999999999995 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.209999999999994 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 75.200000000000003 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 64.239999999999995 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.030000000000001 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 63.140000000000001 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.349999999999994 110.215 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 75.299999999999997 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.420000000000002 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.634 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.400000000000006 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.420000000000002 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 75.150000000000006 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.230000000000004 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 73.420000000000002 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 72.120000000000005 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.140000000000001 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.646 0.239 . . . . 75.530000000000001 111.646 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.099999999999994 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.562 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.209999999999994 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 75.420000000000002 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.532 HG12 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.219999999999999 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.019999999999996 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.319999999999993 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.409999999999997 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 62.140000000000001 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.409999999999997 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.039999999999999 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.230000000000004 109.964 176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 63.240000000000002 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.140000000000001 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 62.119999999999997 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.540000000000006 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 75.010000000000005 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.549999999999997 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 73.140000000000001 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.150000000000006 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.526 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 74.030000000000001 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 72.219999999999999 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 73.129999999999995 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 75.200000000000003 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 71.200000000000003 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.439999999999998 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.219999999999999 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 73.219999999999999 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 75.239999999999995 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.532 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.439999999999998 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.219999999999999 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 45.119999999999997 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 74.030000000000001 111.936 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.439999999999998 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.100000000000001 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 75.420000000000002 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 74.200000000000003 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.109999999999999 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.010000000000005 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.109999999999999 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 73.129999999999995 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 75.329999999999998 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.150000000000006 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.549999999999997 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.526 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 74.310000000000002 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 75.409999999999997 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 74.310000000000002 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.299999999999997 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.319999999999993 111.942 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.510000000000005 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.401 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.540000000000006 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.230000000000004 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 71.219999999999999 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 73.329999999999998 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' ' 73' ' ' CYS . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 64.549999999999997 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 72.25 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.019999999999996 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.701 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.310000000000002 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 75.109999999999999 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.701 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 70.319999999999993 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 71.219999999999999 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 75.010000000000005 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 74.150000000000006 110.456 177.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.240000000000002 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 63.399999999999999 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.451 ' HA ' HD21 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.239999999999995 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.467 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 75.120000000000005 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.629 HG21 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.230000000000004 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.430000000000007 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 64.140000000000001 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.414 ' HD1' HG12 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 75.150000000000006 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.56 HG22 ' HB3' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 72.140000000000001 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 75.340000000000003 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.579 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.120000000000005 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 74.409999999999997 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 64.140000000000001 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.039999999999999 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 74.129999999999995 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.349999999999994 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.019999999999996 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 73.219999999999999 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.329999999999998 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 72.319999999999993 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 73.510000000000005 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.099999999999994 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 73.5 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.547 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 73.120000000000005 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.340000000000003 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 73.299999999999997 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.414 HG12 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.540000000000006 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 74.420000000000002 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.510000000000005 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.430000000000007 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.732 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 71.329999999999998 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.329999999999998 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 71.329999999999998 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.430000000000007 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.230000000000004 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.120000000000005 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 73.329999999999998 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.310000000000002 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 74.430000000000007 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 72.219999999999999 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.56 ' HB3' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 75.400000000000006 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 71.439999999999998 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 71.420000000000002 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.340000000000003 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.450000000000003 111.481 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 75.340000000000003 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 75.140000000000001 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 72.510000000000005 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.140000000000001 111.206 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 71.230000000000004 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 75.099999999999994 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.439999999999998 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.219999999999999 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 14.9 m120 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.129999999999995 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.345 0.117 . . . . 71.200000000000003 111.274 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.230000000000004 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.656 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 72.109999999999999 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 62.420000000000002 110.949 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.586 HG13 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 74.0 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 75.140000000000001 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.530000000000001 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.551 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.430000000000007 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 63.420000000000002 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.219999999999999 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.456 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 73.109999999999999 112.008 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.349999999999994 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.099999999999994 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.140000000000001 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 74.129999999999995 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.349999999999994 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.420000000000002 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 tp60 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 74.450000000000003 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 73.329999999999998 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.516 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 73.420000000000002 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 73.329999999999998 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.469 ' ND1' ' HE2' ' A' ' 22' ' ' LYS . 93.1 m-70 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.409999999999997 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.310000000000002 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 71.219999999999999 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.340000000000003 110.963 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 71.519999999999996 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 75.519999999999996 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 73.049999999999997 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.586 ' HG3' HG13 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.230000000000004 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.130000000000003 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.319999999999993 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.420000000000002 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.419 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.420000000000002 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.489 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.319999999999993 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 75.030000000000001 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.446 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.239999999999995 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.489 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.230000000000004 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 64.239999999999995 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.430000000000007 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 75.450000000000003 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 74.319999999999993 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.329999999999998 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.409999999999997 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.540000000000006 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.329999999999998 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 73.109999999999999 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.439999999999998 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 74.420000000000002 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.430000000000007 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 72.519999999999996 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.439999999999998 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.519999999999996 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 55.229999999999997 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.482 HD12 ' HE2' ' A' ' 97' ' ' MET . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 73.409999999999997 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.530000000000001 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.329999999999998 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.652 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.430000000000007 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.530000000000001 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.476 ' SG ' ' CG ' ' A' ' 53' ' ' TYR . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.030000000000001 110.174 172.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.510000000000005 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 75.140000000000001 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 74.329999999999998 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.329999999999998 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.409 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.319999999999993 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.472 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.150000000000006 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.485 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.099999999999994 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.409 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 52.43 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 71.209999999999994 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 71.219999999999999 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.563 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.129999999999995 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.652 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.430000000000007 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 72.140000000000001 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 64.540000000000006 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 64.099999999999994 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 71.0 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.240000000000002 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 65.519999999999996 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.482 ' HE2' HD12 ' A' ' 70' ' ' LEU . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 74.409999999999997 110.274 177.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.519999999999996 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.209999999999994 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.409999999999997 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.340000000000003 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG22 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 74.319999999999993 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 75.239999999999995 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 75.049999999999997 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.450000000000003 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.329999999999998 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.239999999999995 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.109999999999999 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.65 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 73.340000000000003 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.299999999999997 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 74.450000000000003 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.472 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.219999999999999 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.409999999999997 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 62.420000000000002 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.65 ' SG ' ' HB3' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 73.030000000000001 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 73.109999999999999 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.120000000000005 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 75.230000000000004 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 73.200000000000003 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.430000000000007 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 73.0 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 72.209999999999994 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.299999999999997 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.409999999999997 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.129999999999995 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.219999999999999 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.340000000000003 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.109999999999999 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 72.519999999999996 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.8 m120 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.129999999999995 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.409 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.5 mp . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.299999999999997 110.749 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.430000000000007 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 71.400000000000006 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 71.439999999999998 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.46 HG12 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 72.209999999999994 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.010000000000005 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.51 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 74.239999999999995 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 75.340000000000003 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 71.0 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.209999999999994 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.009999999999998 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.010000000000005 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 71.340000000000003 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 75.530000000000001 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 74.349999999999994 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 72.140000000000001 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.430000000000007 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.607 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.540000000000006 113.12 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 73.349999999999994 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 72.319999999999993 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.607 ' HE3' ' HA ' ' A' ' 33' ' ' PRO . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.340000000000003 109.833 -174.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.040000000000006 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.209999999999994 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.420000000000002 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 73.420000000000002 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 74.140000000000001 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.019999999999996 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.109999999999999 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 74.200000000000003 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.46 ' HG3' HG12 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 73.420000000000002 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.310000000000002 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 72.030000000000001 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.420000000000002 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.458 ' HB3' HD22 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 73.25 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 74.129999999999995 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 75.230000000000004 111.279 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 74.109999999999999 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 71.140000000000001 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 72.430000000000007 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 74.349999999999994 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.140000000000001 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 52.409999999999997 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.209999999999994 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 72.430000000000007 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 71.310000000000002 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.409999999999997 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.129999999999995 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.519999999999996 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.100000000000001 112.851 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.450000000000003 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 73.310000000000002 111.1 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.129999999999995 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 71.299999999999997 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 74.400000000000006 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 74.340000000000003 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 74.409999999999997 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.140000000000001 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 70.010000000000005 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 73.019999999999996 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 73.519999999999996 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.230000000000004 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.540000000000006 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.030000000000001 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.209999999999994 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 65.120000000000005 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.239999999999995 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.420000000000002 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.452 HG22 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 74.109999999999999 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.329999999999998 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 74.109999999999999 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.329999999999998 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.230000000000004 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.109999999999999 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 63.350000000000001 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 71.049999999999997 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 74.420000000000002 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 71.420000000000002 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.420000000000002 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.200000000000003 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 73.450000000000003 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.540000000000006 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 74.129999999999995 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.41 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.409999999999997 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 62.240000000000002 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 73.030000000000001 111.3 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.400000000000006 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 73.219999999999999 112.061 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 61.310000000000002 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 73.230000000000004 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.319999999999993 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 73.040000000000006 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.587 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.219999999999999 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.450000000000003 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 70.349999999999994 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 74.329999999999998 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.340000000000003 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.310000000000002 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.219999999999999 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.587 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.329999999999998 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 74.129999999999995 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.230000000000004 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.040000000000006 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 70.120000000000005 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.109999999999999 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 71.219999999999999 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.400000000000006 111.173 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.420000000000002 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.310000000000002 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.129999999999995 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 72.319999999999993 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 74.109999999999999 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 72.219999999999999 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.41 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.129999999999995 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.109999999999999 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 121.121 0.486 . . . . 71.310000000000002 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 73.129999999999995 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.637 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.439999999999998 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.120000000000005 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG12 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.129999999999995 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.637 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.519999999999996 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.230000000000004 111.276 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.140000000000001 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.230000000000004 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.535 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.420000000000002 111.118 174.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.049999999999997 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.510000000000005 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.519999999999996 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.230000000000004 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.230000000000004 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 72.209999999999994 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.310000000000002 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.010000000000005 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.402 ' HA ' ' HE1' ' A' ' 36' ' ' MET . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 74.239999999999995 111.835 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 74.439999999999998 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 63.149999999999999 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.402 ' HE1' ' HA ' ' A' ' 33' ' ' PRO . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 73.230000000000004 109.644 -176.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.230000000000004 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 75.040000000000006 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.535 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 73.150000000000006 110.615 167.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.129999999999995 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 72.150000000000006 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.587 HD11 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 72.209999999999994 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 73.319999999999993 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.551 ' HG3' HG12 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 74.120000000000005 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 75.019999999999996 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.420000000000002 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.439999999999998 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.209999999999994 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.209999999999994 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.219999999999999 111.707 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 74.040000000000006 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.406 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.409999999999997 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.019999999999996 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.099999999999994 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.587 HH21 HD11 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.140000000000001 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.430000000000007 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.340000000000003 110.93 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.140000000000001 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.510000000000005 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 73.530000000000001 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.569 ' HB3' ' HZ3' ' A' ' 62' ' ' LYS . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.510000000000005 110.282 -175.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 75.450000000000003 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.209999999999994 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.420000000000002 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.448 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.540000000000006 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 74.329999999999998 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.435 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.340000000000003 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 54.100000000000001 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 74.010000000000005 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 71.510000000000005 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.430000000000007 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.443 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.530000000000001 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 72.450000000000003 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.150000000000006 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.568 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 72.109999999999999 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.672 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 72.230000000000004 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.340000000000003 110.676 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.422 ' HB2' ' HB1' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 74.219999999999999 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.571 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.672 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.209999999999994 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.219999999999999 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.239999999999995 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 71.019999999999996 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.140000000000001 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.530000000000001 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 71.420000000000002 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.200000000000003 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 74.010000000000005 111.101 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.443 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.030000000000001 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.549999999999997 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.239999999999995 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.448 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 71.140000000000001 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 72.219999999999999 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.099999999999994 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 73.409999999999997 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.319999999999993 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 74.420000000000002 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.422 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.310000000000002 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.329999999999998 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.319999999999993 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 74.530000000000001 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 74.099999999999994 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.462 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.420000000000002 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 62.439999999999998 109.604 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 74.049999999999997 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.510000000000005 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.530000000000001 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.519999999999996 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.7 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.409999999999997 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.209999999999994 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 74.109999999999999 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 74.329999999999998 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.552 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.329999999999998 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.520000000000003 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.7 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 63.439999999999998 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 74.219999999999999 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.319999999999993 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 64.040000000000006 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 71.310000000000002 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 74.230000000000004 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 72.109999999999999 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.310000000000002 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.209999999999994 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 75.129999999999995 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 74.409999999999997 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 74.310000000000002 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.140000000000001 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.319999999999993 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 74.420000000000002 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 72.0 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.42 HD11 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.77 0.319 . . . . 74.109999999999999 110.837 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 61.25 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.656 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 74.140000000000001 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.319999999999993 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.516 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 73.450000000000003 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 74.299999999999997 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 75.25 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 61.32 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 73.329999999999998 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.417 ' ND2' ' HA ' ' A' ' 21' ' ' ASN . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 65.430000000000007 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.319999999999993 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 52.399999999999999 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 35' ' ' ALA . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.519999999999996 110.253 173.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 73.010000000000005 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.519999999999996 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 55.219999999999999 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 74.510000000000005 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.541 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.340000000000003 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 73.340000000000003 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.530000000000001 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 70.109999999999999 110.795 176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.329999999999998 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 74.209999999999994 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.400000000000006 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.403 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.409999999999997 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.140000000000001 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.462 ' HB3' HD12 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.450000000000003 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.488 HG13 HD11 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 70.25 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.409999999999997 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.409999999999997 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 64.010000000000005 111.922 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.219999999999999 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD11 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 75.129999999999995 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 74.430000000000007 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.099999999999994 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 74.25 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.488 HD11 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 73.519999999999996 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.219999999999999 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.416 ' HA ' ' HB1' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.150000000000006 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 64.219999999999999 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 73.099999999999994 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.209999999999994 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.219999999999999 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 74.450000000000003 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 72.430000000000007 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.497 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 74.549999999999997 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 64.430000000000007 112.376 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.019999999999996 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 74.450000000000003 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 74.230000000000004 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.310000000000002 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 71.200000000000003 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.492 HD12 ' HE2' ' A' ' 97' ' ' MET . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 74.230000000000004 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.230000000000004 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.230000000000004 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.66 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 73.439999999999998 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 75.010000000000005 111.897 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.66 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.349999999999994 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.150000000000006 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.219999999999999 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 74.109999999999999 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.638 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 53.399999999999999 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 74.150000000000006 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 73.329999999999998 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 75.519999999999996 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.209999999999994 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.427 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 74.109999999999999 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' ' HB1' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.428 ' HB ' ' HB1' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 74.519999999999996 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.519999999999996 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.200000000000003 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.452 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.140000000000001 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 74.329999999999998 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.430000000000007 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.476 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.329999999999998 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 62.299999999999997 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.492 ' HE2' HD12 ' A' ' 70' ' ' LEU . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.319999999999993 111.135 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.239999999999995 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.299999999999997 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 75.040000000000006 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 65.230000000000004 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG22 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.109999999999999 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.310000000000002 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 65.049999999999997 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.239999999999995 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.452 ' HB ' ' HB3' ' A' ' 91' ' ' ALA . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.549999999999997 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.543 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 63.310000000000002 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 75.329999999999998 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 75.430000000000007 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.622 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.149999999999999 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.439999999999998 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 74.310000000000002 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.209999999999994 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.413 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 73.230000000000004 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 75.140000000000001 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.120000000000005 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.129999999999995 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.329999999999998 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.458 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 71.319999999999993 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 75.540000000000006 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 72.400000000000006 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.230000000000004 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.230000000000004 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.530000000000001 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 70.109999999999999 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.543 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.409999999999997 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 73.540000000000006 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.530000000000001 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 72.319999999999993 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.010000000000005 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.209999999999994 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.8 m120 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.450000000000003 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.409 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.145 0.498 . . . . 73.319999999999993 110.756 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.239999999999995 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.593 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.549999999999997 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.439999999999998 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 70.209999999999994 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.593 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.530000000000001 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.555 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 75.400000000000006 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.450000000000003 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.430000000000007 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.340000000000003 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.439999999999998 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.420000000000002 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 75.299999999999997 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 75.219999999999999 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 71.349999999999994 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.597 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.310000000000002 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.477 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 74.099999999999994 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.478 ' HA ' ' HE2' ' A' ' 36' ' ' MET . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.597 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.509999999999998 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.409999999999997 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.546 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.329999999999998 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.430000000000007 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 74.219999999999999 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.030000000000001 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 72.239999999999995 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.299999999999997 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 61.310000000000002 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.200000000000003 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 72.420000000000002 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 73.010000000000005 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.329999999999998 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 63.32 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 74.040000000000006 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 65.040000000000006 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB2' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 72.430000000000007 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.420000000000002 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 72.310000000000002 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 64.340000000000003 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.430000000000007 114.494 -171.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 74.420000000000002 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 74.140000000000001 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 74.530000000000001 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.450000000000003 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 74.150000000000006 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.546 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 75.109999999999999 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.409999999999997 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.340000000000003 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.209999999999994 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 74.099999999999994 111.213 -177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.310000000000002 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.040000000000006 112.741 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.109999999999999 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 61.119999999999997 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 63.240000000000002 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.521 ' HZ1' ' HB2' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.209999999999994 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.219999999999999 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.589 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.230000000000004 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 75.129999999999995 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.439999999999998 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.66 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 71.329999999999998 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.420000000000002 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.510000000000005 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 75.310000000000002 109.911 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.349999999999994 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.239999999999995 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.299999999999997 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 74.239999999999995 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.540000000000006 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.219999999999999 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 54.049999999999997 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 74.140000000000001 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.239999999999995 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 71.040000000000006 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.589 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.120000000000005 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.531 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.099999999999994 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 65.310000000000002 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 75.409999999999997 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.471 HD23 ' HZ2' ' A' ' 90' ' ' LYS . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 73.019999999999996 111.403 177.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.340000000000003 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.209999999999994 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.430000000000007 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.340000000000003 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.519999999999996 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.450000000000003 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 71.549999999999997 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.340000000000003 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.592 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.530000000000001 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.119999999999997 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.531 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.530000000000001 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 72.409999999999997 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.340000000000003 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.486 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.129999999999995 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.540000000000006 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.319999999999993 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 74.209999999999994 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.239999999999995 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.439999999999998 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 73.540000000000006 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.486 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 73.019999999999996 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 74.109999999999999 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 71.209999999999994 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 74.519999999999996 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 70.239999999999995 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.030000000000001 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.120000000000005 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 71.340000000000003 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.209999999999994 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.519999999999996 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 70.209999999999994 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 74.430000000000007 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 72.299999999999997 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 74.319999999999993 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 75.420000000000002 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 70.340000000000003 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.510000000000005 109.551 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 111.5 0.185 . . . . 74.340000000000003 111.5 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.439999999999998 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 75.340000000000003 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 75.239999999999995 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.519999999999996 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.439999999999998 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.209999999999994 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.46 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 72.319999999999993 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 65.409999999999997 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.442 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 0.9 OUTLIER -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 73.010000000000005 111.111 177.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 74.010000000000005 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.130000000000003 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.319999999999993 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.010000000000005 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 75.200000000000003 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.430000000000007 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 71.129999999999995 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.409999999999997 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.340000000000003 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.555 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 72.010000000000005 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.210000000000001 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.666 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.239999999999995 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.150000000000006 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.310000000000002 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.442 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.340000000000003 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.340000000000003 109.879 -179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.430000000000007 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.209999999999994 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.409999999999997 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 73.150000000000006 111.492 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 74.510000000000005 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.420000000000002 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 71.209999999999994 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.140000000000001 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.310000000000002 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.462 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.430000000000007 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 73.409999999999997 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.594 HD22 ' HZ2' ' A' ' 20' ' ' LYS . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 71.230000000000004 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 74.439999999999998 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.219999999999999 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.540000000000006 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.666 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.439999999999998 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.140000000000001 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.540000000000006 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 73.439999999999998 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.510000000000005 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 73.019999999999996 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 71.049999999999997 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 74.340000000000003 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 75.310000000000002 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 72.310000000000002 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 64.200000000000003 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 70.310000000000002 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.409999999999997 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 75.439999999999998 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 74.430000000000007 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.51 ' HB3' ' HZ3' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.439999999999998 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.120000000000005 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.567 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 74.150000000000006 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.540000000000006 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.150000000000006 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.230000000000004 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.497 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 74.129999999999995 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.519999999999996 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.140000000000001 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.405 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 74.400000000000006 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.497 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 75.040000000000006 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 71.209999999999994 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.400000000000006 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.451 HG23 ' HB2' ' A' ' 117' ' ' CYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 72.549999999999997 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.438 ' HD2' ' HB ' ' A' ' 84' ' ' ILE . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.539999999999999 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.430000000000007 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 75.430000000000007 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 63.509999999999998 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.530000000000001 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.567 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.219999999999999 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.200000000000003 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 60.340000000000003 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.415 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 75.019999999999996 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.030000000000001 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.209999999999994 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 73.150000000000006 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.219999999999999 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 74.040000000000006 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.209999999999994 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 64.310000000000002 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.129999999999995 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.109999999999999 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.559 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.340000000000003 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.459 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 72.409999999999997 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.049999999999997 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.484 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 73.519999999999996 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.299999999999997 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 74.439999999999998 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.540000000000006 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.534 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 62.130000000000003 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 74.239999999999995 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.209999999999994 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.420000000000002 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.53 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 71.540000000000006 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 73.340000000000003 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.319999999999993 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 73.239999999999995 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 64.409999999999997 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.329999999999998 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 74.530000000000001 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 74.129999999999995 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 71.409999999999997 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . 0.459 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.209999999999994 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 72.120000000000005 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 73.420000000000002 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 70.540000000000006 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 71.329999999999998 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.129999999999995 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 74.510000000000005 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.420000000000002 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 74.299999999999997 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.209999999999994 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.411 ' H ' HD11 ' A' ' 15' ' ' LEU . 5.2 mp . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 75.319999999999993 110.386 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.421 ' HB1' ' HB3' ' A' ' 45' ' ' ARG . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 74.030000000000001 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.578 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.439999999999998 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 55.130000000000003 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.597 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.329999999999998 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 71.319999999999993 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.530000000000001 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 74.030000000000001 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 63.219999999999999 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.209999999999994 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.340000000000003 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 73.420000000000002 111.655 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.439999999999998 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.040000000000006 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.010000000000005 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.310000000000002 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.421 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.239999999999995 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.140000000000001 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 74.230000000000004 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.049999999999997 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 73.25 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 75.299999999999997 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.430000000000007 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 73.310000000000002 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 73.299999999999997 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 65.129999999999995 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.040000000000006 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.209999999999994 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.597 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.120000000000005 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.43 HD22 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 73.0 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.209999999999994 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HA ' HD23 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 73.319999999999993 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.420000000000002 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.509999999999998 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 72.019999999999996 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.494 HD23 ' HZ2' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.150000000000006 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.648 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.209999999999994 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.299999999999997 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 73.150000000000006 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 74.209999999999994 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.140000000000001 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 73.129999999999995 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.239999999999995 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.239999999999995 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.420000000000002 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 74.540000000000006 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 74.430000000000007 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.230000000000004 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.409999999999997 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.319999999999993 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.530000000000001 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.040000000000006 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.340000000000003 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.549 HD13 ' HE1' ' A' ' 97' ' ' MET . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.040000000000006 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.150000000000006 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.019999999999996 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.209999999999994 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.209999999999994 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.130000000000003 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 74.209999999999994 110.392 178.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.439999999999998 111.156 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 71.030000000000001 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.120000000000005 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.230000000000004 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.471 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.230000000000004 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 71.120000000000005 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.439999999999998 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . 0.471 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 64.519999999999996 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.120000000000005 111.304 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.599 HG23 ' HB1' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 72.209999999999994 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.510000000000005 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.099999999999994 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 65.319999999999993 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.319999999999993 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 72.420000000000002 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.319999999999993 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 75.420000000000002 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.430000000000007 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.549 ' HE1' HD13 ' A' ' 70' ' ' LEU . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.420000000000002 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.030000000000001 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.431 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 73.200000000000003 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 74.450000000000003 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.420000000000002 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 52.310000000000002 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.408 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.109999999999999 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.420000000000002 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 74.530000000000001 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.425 ' HD1' ' HB2' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.340000000000003 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 72.239999999999995 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 74.040000000000006 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.64 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.409999999999997 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.340000000000003 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.467 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.519999999999996 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.430000000000007 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.019999999999996 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.140000000000001 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.329999999999998 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.64 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 72.430000000000007 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 74.510000000000005 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.120000000000005 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.599 ' HB1' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.219999999999999 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 75.439999999999998 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.129999999999995 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.420000000000002 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . 0.408 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 75.109999999999999 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 70.329999999999998 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 74.219999999999999 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.340000000000003 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 75.040000000000006 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.439999999999998 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.349999999999994 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.431 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.519999999999996 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.209999999999994 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.6 m120 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.439999999999998 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.441 HD11 ' H ' ' A' ' 15' ' ' LEU . 4.0 mp . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 121.084 0.468 . . . . 74.109999999999999 109.92 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.430000000000007 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.616 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 74.099999999999994 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.530000000000001 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.531 HG13 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 64.129999999999995 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.616 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.530000000000001 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 72.099999999999994 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 75.209999999999994 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.219999999999999 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 74.340000000000003 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.515 ' SG ' ' HD2' ' A' ' 38' ' ' HIS . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.130000000000003 111.487 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.299999999999997 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.319999999999993 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 72.319999999999993 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 62.109999999999999 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 73.109999999999999 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 74.140000000000001 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.129999999999995 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.200000000000003 111.36 179.16 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 73.120000000000005 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.420000000000002 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 73.430000000000007 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.515 ' HD2' ' SG ' ' A' ' 26' ' ' CYS . 23.1 m-70 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.340000000000003 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.340000000000003 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.099999999999994 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.049999999999997 110.259 173.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 74.420000000000002 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.329999999999998 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 63.130000000000003 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' HG13 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.329999999999998 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 74.430000000000007 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 73.219999999999999 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.510000000000005 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 62.119999999999997 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.632 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 74.239999999999995 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.603 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.319999999999993 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.522 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 73.109999999999999 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.350000000000001 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 75.129999999999995 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 74.120000000000005 110.139 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 65.439999999999998 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.310000000000002 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 74.040000000000006 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.219999999999999 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.439999999999998 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 70.209999999999994 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.530000000000001 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.239999999999995 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.519999999999996 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 71.409999999999997 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.319999999999993 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.340000000000003 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 75.219999999999999 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.539 HD12 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 73.140000000000001 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.510000000000005 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 73.140000000000001 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.510000000000005 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 65.0 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.540000000000006 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.597 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 74.200000000000003 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.442 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.150000000000006 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.409999999999997 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 64.219999999999999 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.442 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.409999999999997 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 74.109999999999999 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.340000000000003 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.678 HG22 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 73.239999999999995 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 73.310000000000002 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.430000000000007 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.409999999999997 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 74.049999999999997 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.049999999999997 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 71.420000000000002 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.310000000000002 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.049999999999997 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 73.299999999999997 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 65.019999999999996 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.400000000000006 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.310000000000002 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.539 ' HG3' HD12 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 74.430000000000007 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.329999999999998 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.349999999999994 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.448 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.040000000000006 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.504 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.439999999999998 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 72.219999999999999 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.458 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 64.329999999999998 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.504 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 75.230000000000004 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.099999999999994 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 74.109999999999999 110.807 -171.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.019999999999996 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.340000000000003 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 74.230000000000004 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.704 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 54.399999999999999 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.140000000000001 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.140000000000001 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.120000000000005 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.150000000000006 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.408 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 65.239999999999995 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.510000000000005 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.319999999999993 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.549999999999997 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.439999999999998 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.409999999999997 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 52.399999999999999 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.230000000000004 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.530000000000001 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.430000000000007 110.737 173.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.439999999999998 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.099999999999994 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 103' ' ' ALA . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 75.239999999999995 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 74.040000000000006 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.420000000000002 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.219999999999999 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.461 ' NE2' ' HE1' ' A' ' 104' ' ' MET . 9.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 72.019999999999996 111.757 174.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 73.25 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.219999999999999 109.075 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 120.653 0.264 . . . . 73.450000000000003 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.049999999999997 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.702 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.549999999999997 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.540000000000006 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.551 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.109999999999999 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.702 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.430000000000007 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.510000000000005 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.419 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 74.400000000000006 110.395 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 70.120000000000005 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.340000000000003 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.420000000000002 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.030000000000001 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 72.450000000000003 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 75.530000000000001 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 74.329999999999998 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 75.129999999999995 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.530000000000001 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.530000000000001 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.230000000000004 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.439999999999998 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.539999999999999 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.120000000000005 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.310000000000002 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.458 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 78.7 m-70 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.299999999999997 109.205 173.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 75.150000000000006 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 74.340000000000003 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.540000000000006 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.129999999999995 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 72.209999999999994 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 75.120000000000005 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.551 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 72.310000000000002 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 73.329999999999998 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.120000000000005 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.019999999999996 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB3' HD22 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.540000000000006 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.540000000000006 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 74.040000000000006 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.53 HD22 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 74.439999999999998 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.420000000000002 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.109999999999999 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.129999999999995 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 72.219999999999999 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 74.0 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 72.019999999999996 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.109999999999999 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 73.530000000000001 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.510000000000005 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.540000000000006 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 74.319999999999993 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 73.409999999999997 112.096 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 73.409999999999997 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 73.030000000000001 112.446 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 74.299999999999997 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 74.329999999999998 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 72.040000000000006 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HE2' ' A' ' 97' ' ' MET . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 75.209999999999994 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 75.349999999999994 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 75.209999999999994 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.030000000000001 111.206 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 73.530000000000001 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.219999999999999 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.430000000000007 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 72.329999999999998 110.312 173.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.439999999999998 109.71 -177.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.030000000000001 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.329999999999998 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 72.310000000000002 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 72.129999999999995 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.439999999999998 110.087 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.299999999999997 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.299999999999997 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.219999999999999 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.299999999999997 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.467 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 64.140000000000001 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.150000000000006 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 73.439999999999998 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.299999999999997 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 43.32 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 71.340000000000003 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.340000000000003 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.219999999999999 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 71.150000000000006 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.501 ' HE2' HD13 ' A' ' 70' ' ' LEU . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.430000000000007 110.414 175.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 73.239999999999995 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.109999999999999 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 75.349999999999994 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.419 ' O ' HG21 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.120000000000005 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 73.040000000000006 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 71.430000000000007 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.240000000000002 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 72.519999999999996 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 75.5 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 73.120000000000005 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.340000000000003 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.439999999999998 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.778 HD21 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.319999999999993 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.340000000000003 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 72.409999999999997 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.310000000000002 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.230000000000004 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 70.049999999999997 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.778 ' SG ' HD21 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.030000000000001 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.409999999999997 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.409999999999997 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.019999999999996 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.099999999999994 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.140000000000001 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 70.140000000000001 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 74.329999999999998 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.430000000000007 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 63.409999999999997 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.319999999999993 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 74.310000000000002 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.209999999999994 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.430000000000007 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 70.219999999999999 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.019999999999996 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.402 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.4 mp . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 121.418 0.628 . . . . 74.140000000000001 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.602 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 73.5 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 74.430000000000007 110.578 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.474 HG13 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 73.299999999999997 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 71.310000000000002 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 71.510000000000005 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 72.219999999999999 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.319999999999993 114.04 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 71.409999999999997 112.282 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.409999999999997 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 75.129999999999995 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.488 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.040000000000006 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.230000000000004 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 73.209999999999994 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.439999999999998 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 73.420000000000002 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 72.219999999999999 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.631 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 37.7 mm-40 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.209999999999994 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.400000000000006 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.099999999999994 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 75.209999999999994 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 74.200000000000003 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.510000000000005 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.140000000000001 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.109999999999999 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 73.519999999999996 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 73.430000000000007 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 63.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HG3' HG13 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.430000000000007 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.439999999999998 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.040000000000006 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.329999999999998 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.040000000000006 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 72.25 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.459 HD22 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 74.230000000000004 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.129999999999995 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.010000000000005 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 72.340000000000003 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 73.120000000000005 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 73.230000000000004 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 75.109999999999999 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.400000000000006 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.530000000000001 111.841 -174.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.488 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.109999999999999 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 64.239999999999995 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.329999999999998 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 74.329999999999998 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 73.409999999999997 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.399999999999999 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.329999999999998 111.887 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 75.420000000000002 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.530000000000001 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.420000000000002 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.340000000000003 111.248 176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.030000000000001 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.409999999999997 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 73.349999999999994 110.49 178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.239999999999995 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 73.010000000000005 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 74.409999999999997 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 72.400000000000006 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.230000000000004 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.040000000000006 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.594 HG21 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.549999999999997 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.420000000000002 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 62.509999999999998 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.099999999999994 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.465 HG21 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 74.510000000000005 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.465 HH21 HG21 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.420000000000002 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 73.120000000000005 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.455 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.120000000000005 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.450000000000003 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.040000000000006 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.430000000000007 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.140000000000001 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.420000000000002 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.340000000000003 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.340000000000003 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 74.319999999999993 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 74.209999999999994 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.406 ' O ' HG22 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 75.0 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 72.25 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 75.299999999999997 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.455 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 75.099999999999994 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.627 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.450000000000003 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.430000000000007 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.545 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.519999999999996 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.559 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.439999999999998 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.239999999999995 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.439999999999998 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 73.219999999999999 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.040000000000006 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.230000000000004 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.594 ' SG ' HG21 ' A' ' 84' ' ' ILE . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 74.150000000000006 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.488 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 74.049999999999997 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.340000000000003 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.465 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 72.439999999999998 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.452 ' HB2' HD23 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.310000000000002 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.200000000000003 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 72.010000000000005 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.230000000000004 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.409999999999997 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 73.299999999999997 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.627 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.150000000000006 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 75.450000000000003 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 72.019999999999996 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 73.109999999999999 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.439999999999998 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.219999999999999 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.547 0.862 0 CA-C-O 121.311 0.577 . . . . 75.549999999999997 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HA ' ' HB3' ' A' ' 45' ' ' ARG . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.140000000000001 112.945 177.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.64 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.540000000000006 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 74.319999999999993 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 74.420000000000002 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.64 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.430000000000007 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 74.340000000000003 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.319999999999993 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 71.519999999999996 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.219999999999999 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.030000000000001 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.019999999999996 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 75.340000000000003 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.140000000000001 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.310000000000002 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.140000000000001 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 75.140000000000001 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.647 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.299999999999997 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.62 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.310000000000002 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 74.230000000000004 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 72.209999999999994 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.62 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.340000000000003 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 74.030000000000001 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 75.209999999999994 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 65.0 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 63.509999999999998 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 74.019999999999996 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 75.329999999999998 110.505 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.310000000000002 110.961 179.743 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 73.409999999999997 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.530000000000001 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.340000000000003 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.109999999999999 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.230000000000004 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 74.129999999999995 111.055 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.239999999999995 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.482 ' HG ' ' HG3' ' A' ' 89' ' ' ARG . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.150000000000006 112.777 -178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 54.5 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 72.310000000000002 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.039999999999999 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 71.319999999999993 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 70.310000000000002 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.140000000000001 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.140000000000001 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.310000000000002 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.530000000000001 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.439999999999998 111.808 -179.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.349999999999994 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.455 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 75.040000000000006 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.239999999999995 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 75.230000000000004 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 74.510000000000005 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.494 HD13 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.140000000000001 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 73.25 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.420000000000002 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 70.040000000000006 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.400000000000006 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 72.299999999999997 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.200000000000003 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.402 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.219999999999999 110.251 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 74' ' ' GLU . 27.7 mm-40 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.150000000000006 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 75.439999999999998 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.329999999999998 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 74.140000000000001 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.450000000000003 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 75.230000000000004 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.319999999999993 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 71.409999999999997 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.319999999999993 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 74.219999999999999 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.482 ' HG3' ' HG ' ' A' ' 54' ' ' SER . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 75.310000000000002 110.03 175.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HZ2' HD23 ' A' ' 94' ' ' LEU . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.239999999999995 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.420000000000002 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 72.519999999999996 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.439999999999998 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.541 HD23 ' HZ2' ' A' ' 90' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.329999999999998 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 71.25 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 73.439999999999998 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.494 ' HG3' HD13 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 72.129999999999995 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.349999999999994 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 74.219999999999999 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.530000000000001 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.450000000000003 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HB2' HD11 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 72.420000000000002 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.200000000000003 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.239999999999995 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 72.120000000000005 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.140000000000001 109.397 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.030000000000001 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.510000000000005 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.349999999999994 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 75.030000000000001 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 73.219999999999999 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.099999999999994 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.319999999999993 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HB3' HD12 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.329999999999998 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 73.530000000000001 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.219999999999999 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.329999999999998 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.239999999999995 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 74.120000000000005 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 74.129999999999995 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 73.430000000000007 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.310000000000002 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.329999999999998 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.409999999999997 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.415 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 73.209999999999994 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 74.310000000000002 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 65.150000000000006 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' MET . . . . . 0.415 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 75.540000000000006 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.129999999999995 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.319999999999993 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.140000000000001 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.420000000000002 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.413 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 121.157 0.503 . . . . 73.299999999999997 110.735 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 72.219999999999999 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.631 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 73.230000000000004 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.119999999999997 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.130000000000003 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.631 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 74.519999999999996 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 72.310000000000002 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.41 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 73.439999999999998 110.448 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 73.030000000000001 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.544 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 74.420000000000002 110.105 174.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.450000000000003 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.41 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.420000000000002 112.602 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.329999999999998 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 75.430000000000007 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 72.239999999999995 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.530000000000001 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.452 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.329999999999998 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.437 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.329999999999998 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.030000000000001 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.1 OUTLIER -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 73.040000000000006 111.188 -176.874 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.452 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 74.120000000000005 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.517 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 75.510000000000005 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.209999999999994 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.299999999999997 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.544 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.329999999999998 111.251 167.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.439999999999998 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.319999999999993 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.310000000000002 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 74.420000000000002 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.540000000000006 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.129999999999995 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.049999999999997 111.081 -176.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 73.450000000000003 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 72.430000000000007 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.510000000000005 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.412 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 71.25 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.642 ' HZ3' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 74.109999999999999 110.143 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.030000000000001 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 71.409999999999997 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 73.329999999999998 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.109999999999999 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.517 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 74.329999999999998 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 72.439999999999998 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.229999999999997 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.239999999999995 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 73.510000000000005 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 74.5 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 74.230000000000004 111.575 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.299999999999997 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.507 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.430000000000007 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 71.340000000000003 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.329999999999998 108.964 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 75.329999999999998 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.540000000000006 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 72.530000000000001 112.092 -174.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 72.200000000000003 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.422 ' SG ' ' O ' ' A' ' 70' ' ' LEU . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.019999999999996 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 74.200000000000003 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.209999999999994 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.412 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.109999999999999 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 75.329999999999998 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.319999999999993 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 75.340000000000003 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.319999999999993 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.430000000000007 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 73.409999999999997 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.540000000000006 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.230000000000004 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 73.409999999999997 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.219999999999999 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.230000000000004 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.408 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 73.209999999999994 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.408 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.444 ' HZ2' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 75.340000000000003 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 74.129999999999995 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.219999999999999 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.340000000000003 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 75.239999999999995 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.310000000000002 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.540000000000006 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.450000000000003 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.329999999999998 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 62.240000000000002 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.430000000000007 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.299999999999997 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.040000000000006 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 63.549999999999997 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.428 ' HE1' HE22 ' A' ' 131' ' ' GLN . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 72.209999999999994 111.975 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.520000000000003 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.403 HG11 ' HB3' ' A' ' 90' ' ' LYS . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 63.43 110.802 -169.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 75.420000000000002 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 74.310000000000002 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 72.049999999999997 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.340000000000003 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.646 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 73.430000000000007 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.432 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 75.420000000000002 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.329999999999998 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.439 ' HB2' HD12 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 74.109999999999999 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 75.430000000000007 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.340000000000003 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.646 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.430000000000007 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.439999999999998 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 75.340000000000003 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.120000000000005 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.530000000000001 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 63.240000000000002 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.129999999999995 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.150000000000006 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.230000000000004 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 64.430000000000007 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 72.439999999999998 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.140000000000001 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 74.219999999999999 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 72.420000000000002 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.428 HE22 ' HE1' ' A' ' 104' ' ' MET . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.230000000000004 111.224 175.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 74.200000000000003 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.420000000000002 108.681 174.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 111.88 0.326 . . . . 75.010000000000005 111.88 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.420000000000002 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 74.439999999999998 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.200000000000003 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 64.030000000000001 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.229999999999997 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.340000000000003 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.120000000000005 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.450000000000003 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.319999999999993 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.457 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.510000000000005 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.310000000000002 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.230000000000004 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 73.310000000000002 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 72.439999999999998 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.439999999999998 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.439 ' HB3' HD22 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 75.239999999999995 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 74.5 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.529 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 9.7 tp-100 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.430000000000007 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.591 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 75.340000000000003 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.409999999999997 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 73.540000000000006 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.591 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.420000000000002 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 74.109999999999999 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 73.109999999999999 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.130000000000003 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.310000000000002 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 70.310000000000002 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 64.150000000000006 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.492 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.439999999999998 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.329999999999998 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 64.439999999999998 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.109999999999999 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 73.400000000000006 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 73.329999999999998 112.725 -175.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HB2' ' HE2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 74.230000000000004 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.472 HD22 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 74.519999999999996 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 72.430000000000007 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.409999999999997 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 75.099999999999994 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.109999999999999 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 73.120000000000005 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 63.200000000000003 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 75.019999999999996 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.219999999999999 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.310000000000002 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.219999999999999 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.400000000000006 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 73.230000000000004 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.340000000000003 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.129999999999995 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.549999999999997 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.319999999999993 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.140000000000001 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HZ1' ' HB2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 75.0 112.614 -174.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.310000000000002 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.519999999999996 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.489 ' O ' HG21 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.439999999999998 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 74.239999999999995 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 54.130000000000003 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.489 HG21 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 74.340000000000003 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 73.329999999999998 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.430000000000007 111.141 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.420000000000002 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 72.409999999999997 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.519999999999996 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 75.209999999999994 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 73.019999999999996 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 75.019999999999996 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.130000000000003 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.461 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 75.0 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 64.530000000000001 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.508 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 74.040000000000006 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 73.519999999999996 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.510000000000005 111.686 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 62.329999999999998 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 74.230000000000004 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 71.010000000000005 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.400000000000006 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 74.239999999999995 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.200000000000003 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.450000000000003 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.329999999999998 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.109999999999999 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.140000000000001 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.319999999999993 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 54.210000000000001 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.701 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 75.349999999999994 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 71.099999999999994 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.461 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 75.219999999999999 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.601 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 73.200000000000003 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.420000000000002 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 74.109999999999999 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.310000000000002 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.049999999999997 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 74.019999999999996 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 75.400000000000006 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 65.430000000000007 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.219999999999999 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 74.329999999999998 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.099999999999994 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.140000000000001 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.129999999999995 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.200000000000003 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.310000000000002 110.312 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.109999999999999 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.310000000000002 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 72.099999999999994 110.234 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 72.430000000000007 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.439999999999998 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.601 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.549999999999997 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.701 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 63.149999999999999 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 72.239999999999995 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.150000000000006 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.420000000000002 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 71.200000000000003 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 74.200000000000003 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 111.571 0.211 . . . . 70.340000000000003 111.571 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.009999999999998 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.310000000000002 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.030000000000001 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.543 HG13 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 62.229999999999997 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 72.329999999999998 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 74.530000000000001 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.329999999999998 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.209999999999994 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.569 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.420000000000002 112.136 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 65.030000000000001 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.200000000000003 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.409999999999997 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.530000000000001 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.540000000000006 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 61.43 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.581 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.430000000000007 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.319999999999993 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.420000000000002 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 74.420000000000002 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 71.340000000000003 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 74.439999999999998 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 75.329999999999998 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.25 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.569 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.420000000000002 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.349999999999994 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.209999999999994 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 72.049999999999997 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 74.25 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.209999999999994 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.543 ' HG3' HG13 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 73.540000000000006 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 73.299999999999997 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 74.530000000000001 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.129999999999995 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.476 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 75.439999999999998 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.329999999999998 112.354 -177.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.476 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 72.329999999999998 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.439999999999998 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 71.430000000000007 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 74.230000000000004 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 74.519999999999996 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 74.030000000000001 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 70.519999999999996 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 72.519999999999996 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 62.100000000000001 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 73.019999999999996 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.59 ' HB3' ' HZ3' ' A' ' 62' ' ' LYS . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 74.420000000000002 111.021 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.209999999999994 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.420000000000002 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.099999999999994 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 71.329999999999998 111.655 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 72.409999999999997 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 63.109999999999999 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 73.409999999999997 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 75.239999999999995 109.782 170.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 74.329999999999998 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 70.409999999999997 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.439999999999998 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.140000000000001 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.319999999999993 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.606 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.120000000000005 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.129999999999995 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 72.129999999999995 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.299999999999997 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 75.549999999999997 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.420000000000002 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.530000000000001 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 73.430000000000007 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.63 HG21 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.409999999999997 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 75.299999999999997 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 70.420000000000002 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 75.0 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.489 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.409999999999997 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.150000000000006 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.465 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 75.129999999999995 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 62.219999999999999 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 64.230000000000004 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.219999999999999 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 74.129999999999995 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 74.200000000000003 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 72.310000000000002 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.510000000000005 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 71.239999999999995 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . 0.468 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.219999999999999 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 74.019999999999996 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.230000000000004 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.450000000000003 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 74.409999999999997 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' MET . . . . . 0.511 ' HE1' ' NE2' ' A' ' 131' ' ' GLN . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 73.340000000000003 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.299999999999997 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.445 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 72.420000000000002 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.587 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.310000000000002 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 72.5 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 74.530000000000001 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . 0.506 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.319999999999993 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 73.230000000000004 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 75.329999999999998 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.549999999999997 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.129999999999995 109.964 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.240000000000002 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 62.240000000000002 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.63 ' SG ' HG21 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 53.200000000000003 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 64.209999999999994 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.109999999999999 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.489 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 73.349999999999994 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 60.240000000000002 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.239999999999995 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.340000000000003 110.427 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 75.219999999999999 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.120000000000005 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.587 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.219999999999999 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.299999999999997 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 71.230000000000004 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.310000000000002 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.511 ' NE2' ' HE1' ' A' ' 104' ' ' MET . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 74.120000000000005 110.838 172.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.409999999999997 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 74.430000000000007 110.24 176.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.406 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 121.063 0.459 . . . . 73.150000000000006 110.356 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.487 ' HB2' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 64.140000000000001 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.510000000000005 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 71.239999999999995 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.409999999999997 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.530000000000001 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 74.239999999999995 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.443 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 71.319999999999993 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.219999999999999 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.515 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 74.340000000000003 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.430000000000007 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 70.409999999999997 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.477 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.310000000000002 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.230000000000004 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 74.209999999999994 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.030000000000001 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.519999999999996 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.450000000000003 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . 0.532 ' HB2' ' HZ1' ' A' ' 37' ' ' LYS . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 73.099999999999994 112.795 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 73.340000000000003 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.340000000000003 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.455 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.510000000000005 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.532 ' HZ1' ' HB2' ' A' ' 33' ' ' PRO . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 65.010000000000005 110.118 176.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 72.430000000000007 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.515 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.510000000000005 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 73.540000000000006 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.430000000000007 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 73.420000000000002 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 75.129999999999995 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.329999999999998 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.010000000000005 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.487 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.340000000000003 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.404 ' O ' HD11 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.530000000000001 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.239999999999995 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.420000000000002 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 76' ' ' CYS . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 64.120000000000005 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 74.430000000000007 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.109999999999999 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.47 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.219999999999999 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.329999999999998 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.109999999999999 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 75.129999999999995 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 64.319999999999993 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 74.049999999999997 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.120000000000005 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 74.209999999999994 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.477 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.099999999999994 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.129999999999995 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 73.019999999999996 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.420000000000002 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.484 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.010000000000005 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 72.129999999999995 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 74.450000000000003 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.430000000000007 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.507 HD12 ' HE2' ' A' ' 97' ' ' MET . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.519999999999996 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.130000000000003 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.219999999999999 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 74.450000000000003 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 73.040000000000006 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.47 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.540000000000006 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.455 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.349999999999994 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 72.200000000000003 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.404 HD11 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.510000000000005 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.340000000000003 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.455 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.129999999999995 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.430000000000007 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 74.420000000000002 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.219999999999999 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.230000000000004 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.540000000000006 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 72.239999999999995 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.349999999999994 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.519999999999996 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.413 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 73.310000000000002 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 61.200000000000003 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.540000000000006 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.329999999999998 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.129999999999995 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.507 ' HE2' HD12 ' A' ' 70' ' ' LEU . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 72.430000000000007 110.107 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 71.219999999999999 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.099999999999994 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.349999999999994 112.339 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 75.219999999999999 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.44 ' O ' HG22 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 74.319999999999993 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 74.420000000000002 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.319999999999993 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 64.120000000000005 109.69 173.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.200000000000003 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' TYR . . . . . 0.61 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.299999999999997 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 75.140000000000001 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LYS . . . . . 0.514 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 75.420000000000002 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 63.32 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.019999999999996 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.019999999999996 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 73.519999999999996 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.129999999999995 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' SER . . . . . 0.497 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 64.439999999999998 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 64.310000000000002 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.739 ' SG ' ' HB1' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 74.049999999999997 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.129999999999995 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 75.340000000000003 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.739 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.219999999999999 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ALA . . . . . 0.566 ' HB3' HD23 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 73.109999999999999 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.239999999999995 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 71.319999999999993 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.230000000000004 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.340000000000003 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.61 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.430000000000007 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 72.209999999999994 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 73.409999999999997 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 65.540000000000006 111.563 175.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 71.519999999999996 109.111 -173.765 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.738 0.304 . . . . 73.439999999999998 110.583 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.18 108.53 2.52 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.497 -1.041 . . . . 74.209999999999994 110.497 175.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -63.14 96.33 0.1 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.129 0.972 . . . . 71.099999999999994 110.036 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -69.04 132.44 46.63 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.608 0.763 . . . . 64.239999999999995 110.367 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -157.0 152.58 26.77 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 109.13 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -93.3 176.74 6.28 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.49 0.716 . . . . 74.510000000000005 109.645 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -70.96 -20.9 62.39 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.272 0.629 . . . . 74.420000000000002 111.944 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -113.34 27.78 9.31 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.643 0.777 . . . . 74.349999999999994 110.873 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.4 m -103.91 130.25 51.5 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.371 -0.603 . . . . 71.120000000000005 109.371 175.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -85.13 107.69 17.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.597 0.359 . . . . 71.219999999999999 110.146 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.9 mmm -64.69 -26.17 68.26 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.671 0.789 . . . . 74.409999999999997 110.357 172.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -84.68 113.73 51.06 Favored Pre-proline 0 CA--C 1.55 0.957 0 N-CA-C 108.347 -0.983 . . . . 73.129999999999995 108.347 170.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.86 -36.62 90.13 Favored 'Trans proline' 0 C--N 1.377 2.065 0 C-N-CA 122.913 2.409 . . . . 75.219999999999999 112.348 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.552 ' HB3' HD22 ' A' ' 17' ' ' LEU . 15.1 t70 -151.74 109.9 3.73 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.793 -0.818 . . . . 73.150000000000006 108.793 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -61.51 -27.82 68.87 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.068 0.547 . . . . 75.420000000000002 111.048 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.450000000000003 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.552 HD22 ' HB3' ' A' ' 14' ' ' ASP . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 73.319999999999993 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.519999999999996 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.546 HG12 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.230000000000004 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.529 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.219999999999999 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 74.299999999999997 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 75.310000000000002 112.279 167.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 75.439999999999998 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.119999999999997 109.708 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.510000000000005 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 64.430000000000007 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.239999999999995 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 73.209999999999994 110.333 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 72.549999999999997 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.420000000000002 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.451 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.310000000000002 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.451 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.420000000000002 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.349999999999994 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.319999999999993 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 64.140000000000001 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 74.340000000000003 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 79.7 m-70 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.439999999999998 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.329999999999998 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.430000000000007 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.413 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.310000000000002 110.148 175.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.129999999999995 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 71.510000000000005 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 74.010000000000005 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 73.129999999999995 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 53.329999999999998 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.040000000000006 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 74.109999999999999 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.731 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 72.319999999999993 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 65.409999999999997 111.716 176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 74.450000000000003 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 75.409999999999997 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.439999999999998 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 73.109999999999999 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 73.010000000000005 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.420000000000002 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 75.310000000000002 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 75.420000000000002 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.099999999999994 112.975 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 74.230000000000004 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 75.530000000000001 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 73.109999999999999 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 72.319999999999993 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.430000000000007 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.457 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 74.340000000000003 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.129999999999995 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.499 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 63.140000000000001 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.150000000000006 111.546 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HE2' ' A' ' 97' ' ' MET . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 74.329999999999998 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 73.409999999999997 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.439999999999998 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.040000000000006 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 75.349999999999994 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.430000000000007 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.430000000000007 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.409999999999997 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 64.019999999999996 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.439999999999998 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.340000000000003 107.818 -179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 74.010000000000005 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 75.219999999999999 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.230000000000004 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.310000000000002 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 72.5 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 62.539999999999999 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.310000000000002 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.420000000000002 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.430000000000007 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.349999999999994 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.471 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.019999999999996 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.140000000000001 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 73.209999999999994 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.519999999999996 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 72.120000000000005 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 61.140000000000001 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.501 ' HE2' HD13 ' A' ' 70' ' ' LEU . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 73.409999999999997 109.901 176.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 64.040000000000006 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.439 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 74.349999999999994 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.409999999999997 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 73.430000000000007 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.481 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 75.409999999999997 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.230000000000004 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.310000000000002 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.400000000000006 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 102' ' ' LYS . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.594 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 72.200000000000003 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.540000000000006 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.409999999999997 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 75.400000000000006 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.200000000000003 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.519999999999996 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.329999999999998 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.209999999999994 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.47 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 72.409999999999997 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.549999999999997 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.329999999999998 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.47 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.150000000000006 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.450000000000003 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 73.140000000000001 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 71.219999999999999 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.209999999999994 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.040000000000006 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.429 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.540000000000006 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 71.040000000000006 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 64.049999999999997 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.594 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.430000000000007 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 74.140000000000001 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.100000000000001 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 73.540000000000006 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.010000000000005 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 75.239999999999995 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 74.049999999999997 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttm . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.726 -0.842 . . . . 74.349999999999994 108.726 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -129.4 68.86 0.54 Allowed Glycine 0 C--N 1.343 0.958 0 O-C-N 123.287 0.367 . . . . 75.239999999999995 112.27 -176.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -107.23 -1.9 21.33 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.252 0.621 . . . . 74.510000000000005 111.056 169.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -77.82 126.29 30.63 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.314 -0.625 . . . . 72.239999999999995 109.314 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -64.41 102.89 0.58 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.804 0.842 . . . . 72.239999999999995 109.203 176.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -86.76 118.91 26.47 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.456 0.702 . . . . 74.140000000000001 110.001 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -167.23 -50.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.527 1.131 . . . . 75.430000000000007 108.462 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -79.63 73.26 6.33 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.457 -0.792 . . . . 74.209999999999994 109.425 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.1 t -179.15 159.62 0.98 Allowed 'General case' 0 C--O 1.242 0.683 0 C-N-CA 125.708 1.603 . . . . 72.120000000000005 107.75 -178.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -63.46 96.74 0.12 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 121.294 0.569 . . . . 74.140000000000001 109.607 174.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.0 mtp -70.05 -30.45 67.71 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.685 -0.689 . . . . 72.129999999999995 111.27 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -132.23 152.82 80.8 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 123.754 0.821 . . . . 71.430000000000007 110.133 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.14 -51.83 6.95 Favored 'Trans proline' 0 C--N 1.389 2.69 0 C-N-CA 123.249 2.633 . . . . 64.209999999999994 112.734 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.575 ' HB3' HD22 ' A' ' 17' ' ' LEU . 15.2 t70 -161.63 111.02 1.56 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.311 0.577 . . . . 75.310000000000002 110.203 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.424 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.09 -33.15 71.69 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.36 1.064 . . . . 75.109999999999999 110.938 -178.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.129999999999995 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.420000000000002 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 74.310000000000002 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.6 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.200000000000003 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.140000000000001 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.450000000000003 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 61.530000000000001 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 71.510000000000005 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.049999999999997 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.420000000000002 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.430000000000007 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.239999999999995 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 71.140000000000001 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 73.030000000000001 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.553 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 75.219999999999999 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.45 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 73.010000000000005 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.45 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.310000000000002 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 73.340000000000003 111.508 -176.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 74.319999999999993 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 74.120000000000005 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.239999999999995 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.109999999999999 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 72.219999999999999 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.230000000000004 110.928 -178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.099999999999994 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 63.039999999999999 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 64.540000000000006 111.675 -178.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.310000000000002 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.447 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.030000000000001 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.536 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.120000000000005 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.536 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 75.439999999999998 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.447 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.030000000000001 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 73.209999999999994 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.559 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 64.519999999999996 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.019999999999996 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 75.439999999999998 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.219999999999999 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.420000000000002 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.519999999999996 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 64.230000000000004 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 74.030000000000001 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 73.239999999999995 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 74.109999999999999 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 73.329999999999998 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 74.25 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 74.439999999999998 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.230000000000004 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.429 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 73.420000000000002 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.430000000000007 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.549999999999997 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.340000000000003 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 74.200000000000003 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 75.239999999999995 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.420000000000002 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.467 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.030000000000001 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.499 ' HB3' ' HZ2' ' A' ' 90' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.040000000000006 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 74.340000000000003 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.430000000000007 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.140000000000001 111.19 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 74.25 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.492 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.150000000000006 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.729 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.150000000000006 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.519999999999996 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.049999999999997 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.467 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.040000000000006 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 72.049999999999997 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 72.349999999999994 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.140000000000001 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 74.439999999999998 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.418 HG21 ' HB1' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.310000000000002 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.120000000000005 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.499 ' HZ2' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 73.420000000000002 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.528 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 75.140000000000001 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.510000000000005 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.430000000000007 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 64.209999999999994 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.239999999999995 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.299999999999997 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 75.239999999999995 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 75.439999999999998 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.230000000000004 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.310000000000002 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.120000000000005 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 65.409999999999997 110.557 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 75.349999999999994 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.329999999999998 112.007 -174.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.140000000000001 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.528 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 74.230000000000004 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.019999999999996 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.540000000000006 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 75.299999999999997 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.140000000000001 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.504 HD21 ' HB1' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 75.040000000000006 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.420000000000002 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.109999999999999 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.310000000000002 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 71.340000000000003 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.420000000000002 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.299999999999997 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 63.420000000000002 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.349999999999994 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.487 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.504 ' HB1' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 70.219999999999999 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.450000000000003 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 61.119999999999997 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.458 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 72.510000000000005 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.120000000000005 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.450000000000003 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.683 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.239999999999995 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 72.010000000000005 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.430000000000007 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.439999999999998 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 75.420000000000002 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.549999999999997 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 73.340000000000003 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HE2' ' HA ' ' A' ' 1' ' ' MET . 29.0 mmt . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.593 -0.521 . . . . 75.540000000000006 109.593 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.47 99.31 0.72 Allowed Glycine 0 C--N 1.348 1.2 0 O-C-N 123.968 0.792 . . . . 71.349999999999994 111.638 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -120.81 18.76 11.84 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.484 0.713 . . . . 53.420000000000002 110.767 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -78.06 -7.2 56.62 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.302 0.641 . . . . 71.430000000000007 110.295 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -57.1 114.65 2.23 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 124.014 0.926 . . . . 75.25 109.925 174.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -66.09 118.07 9.32 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 124.131 0.894 . . . . 74.219999999999999 110.203 -176.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -74.92 77.1 2.16 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.337 1.055 . . . . 65.150000000000006 110.16 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -172.94 164.77 5.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.84 1.256 . . . . 72.329999999999998 109.828 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 p -51.44 92.33 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 125.324 1.45 . . . . 54.140000000000001 114.128 -169.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.62 90.34 2.34 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 107.156 -1.424 . . . . 75.420000000000002 107.156 168.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 50.9 -76.02 0.01 OUTLIER 'General case' 0 C--N 1.359 0.987 0 C-N-CA 126.634 1.974 . . . . 74.109999999999999 111.492 -167.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -109.95 100.52 43.62 Favored Pre-proline 0 N--CA 1.473 0.685 0 N-CA-C 107.792 -1.188 . . . . 72.349999999999994 107.792 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.5 -39.03 75.54 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.501 2.801 . . . . 75.519999999999996 113.185 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -177.19 112.81 0.09 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.564 1.145 . . . . 74.340000000000003 107.993 177.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp -60.97 -33.14 72.74 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 75.450000000000003 109.947 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.434 ' HB2' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 74.549999999999997 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.593 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 73.530000000000001 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.540000000000006 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 73.340000000000003 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.593 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 73.200000000000003 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.019999999999996 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 74.450000000000003 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.209999999999994 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.421 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 62.329999999999998 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 64.540000000000006 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 73.450000000000003 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 73.299999999999997 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.239999999999995 111.555 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.329999999999998 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.540000000000006 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.406 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 74.230000000000004 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.496 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 74.209999999999994 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.010000000000005 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.430000000000007 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 75.420000000000002 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 74.519999999999996 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.450000000000003 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.421 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 65.230000000000004 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.430000000000007 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.450000000000003 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.049999999999997 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.329999999999998 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.434 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 73.0 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 74.209999999999994 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 73.409999999999997 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 72.450000000000003 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.522 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.109999999999999 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.310000000000002 111.268 175.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.239999999999995 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.219999999999999 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 72.349999999999994 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.409999999999997 109.805 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.340000000000003 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.400000000000006 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.340000000000003 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.120000000000005 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.439999999999998 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 73.200000000000003 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 73.430000000000007 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.329999999999998 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 73.510000000000005 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 75.340000000000003 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 75.209999999999994 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.230000000000004 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 75.019999999999996 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 74.439999999999998 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.43 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.439999999999998 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 73.439999999999998 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.409999999999997 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 73.140000000000001 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.099999999999994 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.522 ' SG ' ' HA ' ' A' ' 50' ' ' ALA . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.209999999999994 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 74.010000000000005 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 75.030000000000001 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.495 HD11 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.040000000000006 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.424 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.510000000000005 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 73.310000000000002 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 74.239999999999995 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.424 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.329999999999998 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.209999999999994 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 74.319999999999993 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.411 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.329999999999998 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 74.019999999999996 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.040000000000006 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.129999999999995 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 74.310000000000002 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.502 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.310000000000002 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.140000000000001 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.239999999999995 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.319999999999993 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 73.319999999999993 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 71.329999999999998 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 73.209999999999994 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.150000000000006 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.329999999999998 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.219999999999999 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.120000000000005 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.219999999999999 109.649 178.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.442 ' HB1' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.200000000000003 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.434 ' HE2' ' NE2' ' A' ' 131' ' ' GLN . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 74.439999999999998 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.150000000000006 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.219999999999999 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.420000000000002 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 74.329999999999998 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 71.319999999999993 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.747 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.129999999999995 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.230000000000004 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 72.219999999999999 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.319999999999993 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.329999999999998 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 63.340000000000003 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 71.319999999999993 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.747 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 71.319999999999993 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.230000000000004 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.329999999999998 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.450000000000003 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 74.329999999999998 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.099999999999994 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 65.329999999999998 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 75.349999999999994 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.510000000000005 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 73.120000000000005 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.442 ' SG ' ' HB1' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.329999999999998 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.140000000000001 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.430000000000007 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.420000000000002 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.434 ' NE2' ' HE2' ' A' ' 104' ' ' MET . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.349999999999994 111.677 176.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 71.439999999999998 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 73.109999999999999 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.22 -0.659 . . . . 74.099999999999994 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.91 25.58 5.24 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-O 119.93 -0.372 . . . . 64.400000000000006 113.033 -176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m170 -74.88 82.01 2.16 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.002 0.521 . . . . 74.319999999999993 110.16 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.4 m80 -153.05 152.59 31.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.421 1.488 . . . . 74.340000000000003 107.926 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -66.3 140.85 58.14 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 109.51 -0.552 . . . . 75.109999999999999 109.51 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -66.65 136.49 55.63 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.301 0.375 . . . . 73.099999999999994 110.16 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -80.54 113.66 18.89 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.642 0.777 . . . . 71.299999999999997 109.819 -174.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -82.22 61.9 5.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.949 0.881 . . . . 74.420000000000002 110.422 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -81.14 19.67 0.89 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.193 0.997 . . . . 74.409999999999997 112.909 -172.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -83.52 104.98 14.08 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 107.962 -1.125 . . . . 75.549999999999997 107.962 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.0 mmt -65.6 -35.34 80.54 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.193 0.597 . . . . 74.439999999999998 111.894 -173.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -96.55 112.3 59.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 108.485 -0.932 . . . . 73.299999999999997 108.485 168.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.91 -37.93 18.35 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.503 2.135 . . . . 74.519999999999996 111.336 173.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -161.35 113.15 1.8 Allowed 'General case' 0 C--N 1.349 0.585 0 CA-C-N 115.52 -0.764 . . . . 63.420000000000002 109.426 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.422 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.66 -34.4 75.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.150000000000006 110.072 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 74.230000000000004 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.57 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.229999999999997 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 64.299999999999997 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.5 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.239999999999995 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.57 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.400000000000006 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.209999999999994 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.412 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.329999999999998 110.291 174.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.310000000000002 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 74.239999999999995 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.310000000000002 112.511 -171.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.140000000000001 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 73.129999999999995 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.549999999999997 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 75.230000000000004 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.602 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 62.039999999999999 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.030000000000001 113.019 -174.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 71.349999999999994 111.523 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.602 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.519999999999996 111.308 -177.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 74.310000000000002 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 74.109999999999999 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.349999999999994 110.478 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.129999999999995 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.450000000000003 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 75.099999999999994 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.230000000000004 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.230000000000004 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 75.549999999999997 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.409999999999997 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.209999999999994 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.329999999999998 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.150000000000006 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 75.040000000000006 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 71.439999999999998 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.219999999999999 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.510000000000005 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD21 ' HZ2' ' A' ' 20' ' ' LYS . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.409999999999997 109.927 173.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.129999999999995 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 74.329999999999998 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 74.519999999999996 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 71.319999999999993 109.979 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.010000000000005 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 73.349999999999994 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.299999999999997 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 72.329999999999998 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 74.420000000000002 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.140000000000001 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.349999999999994 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 72.310000000000002 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.540000000000006 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.463 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 75.319999999999993 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.439999999999998 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 55.200000000000003 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 74.129999999999995 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.149999999999999 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 74.420000000000002 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.420000000000002 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.439999999999998 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.409999999999997 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.209999999999994 111.169 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' CE2' ' A' ' 83' ' ' PHE . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 72.049999999999997 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 73.430000000000007 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 65.340000000000003 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.239999999999995 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.450000000000003 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.239999999999995 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 74.329999999999998 112.702 -172.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.409999999999997 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.506 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.340000000000003 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.329999999999998 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 61.399999999999999 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.483 ' HB3' ' HB3' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 73.219999999999999 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 71.129999999999995 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 75.219999999999999 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.530000000000001 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.506 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.049999999999997 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.439999999999998 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.437 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 74.349999999999994 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.531 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.120000000000005 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 73.239999999999995 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 74.230000000000004 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.437 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 73.430000000000007 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 72.519999999999996 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 73.340000000000003 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 74.540000000000006 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 74.340000000000003 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.453 ' O ' HG21 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 74.209999999999994 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 74.329999999999998 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 75.430000000000007 111.695 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.019999999999996 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.506 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 72.319999999999993 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.634 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.409999999999997 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 74.25 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 71.450000000000003 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 87' ' ' TYR . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 60.450000000000003 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.120000000000005 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 75.099999999999994 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 65.019999999999996 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.506 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 74.129999999999995 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.473 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.200000000000003 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.430000000000007 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.455 ' SG ' ' CB ' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.310000000000002 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 75.129999999999995 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.209999999999994 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 75.200000000000003 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 64.239999999999995 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.030000000000001 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 63.140000000000001 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.349999999999994 110.215 175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 75.299999999999997 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.420000000000002 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.634 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.400000000000006 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.420000000000002 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 75.150000000000006 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.230000000000004 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 73.420000000000002 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 72.120000000000005 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.140000000000001 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.484 1.275 0 N-CA-C 110.23 -0.285 . . . . 72.120000000000005 110.23 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 78.7 60.42 2.62 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 111.116 -0.793 . . . . 62.509999999999998 111.116 -173.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -63.62 98.05 0.17 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.638 0.775 . . . . 74.540000000000006 109.723 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -99.05 158.82 15.4 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.072 0.949 . . . . 75.450000000000003 110.854 -174.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.442 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 33.9 t60 -154.31 156.04 36.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 107.569 -1.271 . . . . 73.329999999999998 107.569 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -56.59 130.79 46.69 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 123.368 0.417 . . . . 73.310000000000002 110.58 176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -78.6 -18.72 54.14 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.909 0.484 . . . . 74.299999999999997 112.174 -170.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -89.35 -1.73 58.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.004 0.522 . . . . 74.439999999999998 111.529 172.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 t -89.3 120.39 30.61 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.648 -0.871 . . . . 75.150000000000006 108.648 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -86.41 55.06 3.38 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.015 0.912 . . . . 74.5 109.866 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.3 mtt -119.94 -52.33 2.21 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.883 1.273 . . . . 75.129999999999995 108.851 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 62.46 143.81 0.07 OUTLIER Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 125.252 1.421 . . . . 71.030000000000001 112.64 -172.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.442 ' HG3' ' HB2' ' A' ' 5' ' ' HIS . 14.3 Cg_exo -66.47 -42.03 10.62 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.872 1.714 . . . . 75.140000000000001 110.664 171.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 19.0 t0 -179.9 119.43 0.06 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.322 1.049 . . . . 72.409999999999997 110.185 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.03 -37.74 80.69 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.408 0.683 . . . . 75.530000000000001 111.646 176.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.099999999999994 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.562 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.209999999999994 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 75.420000000000002 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.532 HG12 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.219999999999999 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.562 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.019999999999996 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.319999999999993 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.409999999999997 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 62.140000000000001 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.409999999999997 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.039999999999999 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.230000000000004 109.964 176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 63.240000000000002 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.140000000000001 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 62.119999999999997 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.540000000000006 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 75.010000000000005 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.549999999999997 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 73.140000000000001 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.463 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.150000000000006 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.526 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 74.030000000000001 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 72.219999999999999 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 73.129999999999995 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 75.200000000000003 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 71.200000000000003 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.439999999999998 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.219999999999999 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 73.219999999999999 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 75.239999999999995 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.532 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.439999999999998 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.219999999999999 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 45.119999999999997 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 74.030000000000001 111.936 178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.439999999999998 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.100000000000001 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 75.420000000000002 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 74.200000000000003 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.109999999999999 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.010000000000005 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.109999999999999 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 73.129999999999995 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 75.329999999999998 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.150000000000006 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.549999999999997 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.526 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 74.310000000000002 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 75.409999999999997 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 74.310000000000002 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.299999999999997 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.319999999999993 111.942 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.510000000000005 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.401 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.540000000000006 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.230000000000004 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 71.219999999999999 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 73.329999999999998 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' ' 73' ' ' CYS . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 64.549999999999997 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 72.25 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.019999999999996 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.701 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.310000000000002 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 75.109999999999999 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.701 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 70.319999999999993 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 71.219999999999999 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 75.010000000000005 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 74.150000000000006 110.456 177.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.240000000000002 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 63.399999999999999 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.451 ' HA ' HD21 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.239999999999995 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.467 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 75.120000000000005 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.629 HG21 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.230000000000004 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.430000000000007 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.467 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 64.140000000000001 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.414 ' HD1' HG12 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 75.150000000000006 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.56 HG22 ' HB3' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 72.140000000000001 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 75.340000000000003 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.579 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.120000000000005 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 74.409999999999997 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 64.140000000000001 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.039999999999999 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 74.129999999999995 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.414 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.349999999999994 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.019999999999996 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 73.219999999999999 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.329999999999998 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 72.319999999999993 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 73.510000000000005 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.099999999999994 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 73.5 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.547 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 73.120000000000005 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.340000000000003 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 73.299999999999997 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.414 HG12 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.540000000000006 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 74.420000000000002 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.510000000000005 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.445 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.430000000000007 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.732 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 71.329999999999998 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.329999999999998 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 71.329999999999998 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.430000000000007 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.230000000000004 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.120000000000005 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 73.329999999999998 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.310000000000002 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 74.430000000000007 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 72.219999999999999 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.56 ' HB3' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 75.400000000000006 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 71.439999999999998 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 71.420000000000002 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.340000000000003 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.450000000000003 111.481 176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 75.340000000000003 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 75.140000000000001 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 72.510000000000005 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.140000000000001 111.206 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 71.230000000000004 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 75.099999999999994 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.439999999999998 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.219999999999999 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 14.9 m120 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.129999999999995 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.436 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.003 -0.369 . . . . 73.140000000000001 110.003 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 79.19 -90.4 1.21 Allowed Glycine 0 C--N 1.349 1.277 0 CA-C-O 119.782 -0.455 . . . . 73.349999999999994 112.821 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.9 p80 40.66 66.41 0.64 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.829 1.652 . . . . 75.010000000000005 112.277 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -148.49 -60.6 0.24 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.954 -1.021 . . . . 74.150000000000006 109.241 -174.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -162.23 125.83 3.06 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.027 0.931 . . . . 73.120000000000005 108.645 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -66.75 89.67 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.902 0.858 . . . . 75.0 109.165 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -74.27 132.8 42.44 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.884 -1.053 . . . . 74.099999999999994 111.173 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -143.54 148.69 36.35 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.513 1.125 . . . . 72.400000000000006 109.362 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.32 -167.91 2.04 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.702 0.801 . . . . 74.510000000000005 109.915 177.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.554 ' HA ' HD11 ' A' ' 15' ' ' LEU . 7.6 t60 -80.73 62.37 4.74 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-O 121.967 0.889 . . . . 73.409999999999997 109.052 174.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.29 -25.68 13.23 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.365 1.066 . . . . 72.140000000000001 109.466 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -67.31 143.83 97.68 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 115.47 -0.786 . . . . 75.319999999999993 108.917 173.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -60.6 -27.61 85.14 Favored 'Trans proline' 0 C--N 1.377 2.076 0 C-N-CA 122.665 2.243 . . . . 71.310000000000002 112.232 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.524 ' HB3' HD22 ' A' ' 17' ' ' LEU . 33.0 t70 -167.48 102.91 0.51 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.974 0.91 . . . . 74.010000000000005 108.586 176.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.554 HD11 ' HA ' ' A' ' 10' ' ' HIS . 5.5 mp -62.74 -24.32 67.64 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.336 0.654 . . . . 71.200000000000003 111.274 177.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.230000000000004 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.656 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 72.109999999999999 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 62.420000000000002 110.949 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.586 HG13 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 74.0 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 75.140000000000001 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.530000000000001 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.551 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.430000000000007 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 63.420000000000002 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.551 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.219999999999999 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.456 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 73.109999999999999 112.008 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.349999999999994 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.099999999999994 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.140000000000001 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 74.129999999999995 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.349999999999994 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.420000000000002 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 tp60 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 74.450000000000003 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 73.329999999999998 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.516 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 73.420000000000002 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 73.329999999999998 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.469 ' ND1' ' HE2' ' A' ' 22' ' ' LYS . 93.1 m-70 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.409999999999997 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.310000000000002 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 71.219999999999999 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.340000000000003 110.963 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 71.519999999999996 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 75.519999999999996 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 73.049999999999997 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.586 ' HG3' HG13 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.230000000000004 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.130000000000003 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.319999999999993 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.420000000000002 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.419 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.420000000000002 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.489 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.319999999999993 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 75.030000000000001 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.446 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.239999999999995 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.489 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.230000000000004 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 64.239999999999995 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.430000000000007 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 75.450000000000003 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 74.319999999999993 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.563 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.329999999999998 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.516 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.409999999999997 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.540000000000006 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.329999999999998 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 73.109999999999999 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.439999999999998 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 74.420000000000002 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.430000000000007 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 72.519999999999996 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.439999999999998 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.519999999999996 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 55.229999999999997 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.482 HD12 ' HE2' ' A' ' 97' ' ' MET . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 73.409999999999997 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.530000000000001 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.329999999999998 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.652 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.430000000000007 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.530000000000001 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.476 ' SG ' ' CG ' ' A' ' 53' ' ' TYR . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.030000000000001 110.174 172.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.510000000000005 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 75.140000000000001 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 74.329999999999998 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.329999999999998 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.409 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.319999999999993 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.472 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.150000000000006 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.485 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.099999999999994 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.409 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 52.43 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 71.209999999999994 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 71.219999999999999 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.563 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.129999999999995 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.652 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.430000000000007 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 72.140000000000001 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 64.540000000000006 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 64.099999999999994 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 71.0 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.240000000000002 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 65.519999999999996 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.482 ' HE2' HD12 ' A' ' 70' ' ' LEU . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 74.409999999999997 110.274 177.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.519999999999996 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.209999999999994 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.409999999999997 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.340000000000003 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG22 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 74.319999999999993 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 75.239999999999995 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 75.049999999999997 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.496 HG22 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.450000000000003 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.329999999999998 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.239999999999995 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.109999999999999 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.65 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 73.340000000000003 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.299999999999997 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 74.450000000000003 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.472 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.219999999999999 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.409999999999997 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 62.420000000000002 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.65 ' SG ' ' HB3' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 73.030000000000001 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 73.109999999999999 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.120000000000005 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 75.230000000000004 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 73.200000000000003 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.430000000000007 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 73.0 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 72.209999999999994 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.299999999999997 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.409999999999997 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.129999999999995 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.219999999999999 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.340000000000003 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.109999999999999 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 72.519999999999996 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.8 m120 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.129999999999995 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 ttp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.897 -0.409 . . . . 72.25 109.897 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.18 83.81 0.35 Allowed Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.462 -0.655 . . . . 73.450000000000003 111.462 177.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -72.52 93.8 1.61 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.046 0.538 . . . . 71.329999999999998 109.989 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -67.43 110.87 3.78 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 108.45 -0.944 . . . . 74.040000000000006 108.45 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -119.59 26.79 9.15 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.845 0.458 . . . . 71.409999999999997 111.59 -174.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.0 p-80 -61.32 -24.03 66.14 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 120.886 0.374 . . . . 64.040000000000006 110.974 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -72.06 -40.0 68.65 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.681 1.192 . . . . 72.310000000000002 111.217 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -102.01 104.05 14.69 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.223 0.609 . . . . 75.150000000000006 109.651 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -54.66 100.77 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.658 1.183 . . . . 74.310000000000002 112.685 -175.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -148.01 74.86 1.32 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 106.187 -1.783 . . . . 70.319999999999993 106.187 178.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.424 ' HG3' HD21 ' A' ' 12' ' ' ASN . 21.5 ptp -55.38 -36.14 66.07 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.813 1.245 . . . . 74.129999999999995 113.804 -165.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.424 HD21 ' HG3' ' A' ' 11' ' ' MET . 37.2 m-80 -120.15 124.48 27.77 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 107.932 -1.136 . . . . 63.130000000000003 107.932 171.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.73 -44.81 44.25 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.362 2.041 . . . . 73.129999999999995 110.69 169.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.493 ' HB3' HD23 ' A' ' 17' ' ' LEU . 10.0 t70 -175.25 117.26 0.16 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 73.439999999999998 109.177 176.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.409 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.5 mp -57.96 -36.15 72.17 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.299999999999997 110.749 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.430000000000007 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.615 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 71.400000000000006 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 71.439999999999998 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.46 HG12 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.615 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 72.209999999999994 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.010000000000005 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.51 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 74.239999999999995 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 75.340000000000003 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 71.0 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.51 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.209999999999994 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.009999999999998 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.010000000000005 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 71.340000000000003 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 75.530000000000001 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 74.349999999999994 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 72.140000000000001 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.430000000000007 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.607 ' HA ' ' HE3' ' A' ' 36' ' ' MET . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.540000000000006 113.12 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 73.349999999999994 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 72.319999999999993 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.607 ' HE3' ' HA ' ' A' ' 33' ' ' PRO . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.340000000000003 109.833 -174.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.040000000000006 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.209999999999994 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.420000000000002 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 73.420000000000002 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 74.140000000000001 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.019999999999996 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.109999999999999 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 74.200000000000003 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.46 ' HG3' HG12 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 73.420000000000002 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.310000000000002 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 72.030000000000001 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.420000000000002 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.458 ' HB3' HD22 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 73.25 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 74.129999999999995 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 75.230000000000004 111.279 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 74.109999999999999 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 71.140000000000001 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 72.430000000000007 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 74.349999999999994 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.140000000000001 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.41 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 52.409999999999997 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.209999999999994 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 72.430000000000007 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 71.310000000000002 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.41 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.409999999999997 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.129999999999995 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.519999999999996 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.100000000000001 112.851 176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.450000000000003 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 73.310000000000002 111.1 177.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.129999999999995 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 71.299999999999997 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 74.400000000000006 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 74.340000000000003 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 74.409999999999997 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.140000000000001 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 70.010000000000005 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 73.019999999999996 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 73.519999999999996 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.230000000000004 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.540000000000006 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.030000000000001 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.209999999999994 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 65.120000000000005 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.239999999999995 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.420000000000002 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.405 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.452 HG22 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 74.109999999999999 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.329999999999998 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 74.109999999999999 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.329999999999998 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.230000000000004 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.109999999999999 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 63.350000000000001 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 71.049999999999997 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 74.420000000000002 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 71.420000000000002 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.420000000000002 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.200000000000003 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 73.450000000000003 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.540000000000006 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 74.129999999999995 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.41 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.409999999999997 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 62.240000000000002 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 73.030000000000001 111.3 -178.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.400000000000006 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 73.219999999999999 112.061 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.481 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 61.310000000000002 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.415 ' HB ' ' HB3' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 73.230000000000004 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.319999999999993 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 73.040000000000006 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.587 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.219999999999999 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.450000000000003 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 70.349999999999994 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 74.329999999999998 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.340000000000003 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.310000000000002 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.219999999999999 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.587 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.329999999999998 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 74.129999999999995 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.230000000000004 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.040000000000006 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 70.120000000000005 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.4 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.109999999999999 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 71.219999999999999 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.400000000000006 111.173 178.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.420000000000002 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.310000000000002 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.407 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.129999999999995 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 72.319999999999993 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 74.109999999999999 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 72.219999999999999 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.41 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.129999999999995 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.109999999999999 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.614 0.245 . . . . 63.520000000000003 110.645 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.42 53.3 4.78 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.564 -0.289 . . . . 72.340000000000003 113.111 -178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -75.19 89.65 2.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 107.828 -1.175 . . . . 71.140000000000001 107.828 171.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.21 -63.89 1.14 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.92 0.888 . . . . 73.349999999999994 111.297 -170.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -166.54 126.68 1.61 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.606 -0.887 . . . . 75.549999999999997 108.606 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.5 91.73 0.08 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 109.704 -0.48 . . . . 73.420000000000002 109.704 178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -76.35 115.17 15.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.6 0.76 . . . . 64.439999999999998 109.411 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -60.84 117.75 5.81 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 124.122 0.889 . . . . 72.140000000000001 109.855 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 p -78.41 -168.31 1.31 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.969 0.908 . . . . 74.230000000000004 110.204 175.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -76.31 -171.5 1.79 Allowed 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.971 -0.456 . . . . 72.420000000000002 110.094 172.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 78.9 mtp -62.85 -21.78 66.21 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 111.844 0.313 . . . . 71.530000000000001 111.844 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.82 121.82 79.47 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 108.069 -1.086 . . . . 75.450000000000003 108.069 163.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -47.63 -36.5 25.16 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 123.91 3.073 . . . . 72.230000000000004 113.687 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.507 ' HB3' HD22 ' A' ' 17' ' ' LEU . 21.4 t0 -165.43 114.2 1.02 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.069 -0.969 . . . . 73.209999999999994 109.206 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.37 -32.99 71.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.233 0.613 . . . . 71.310000000000002 110.434 177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 73.129999999999995 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.637 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.439999999999998 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.120000000000005 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG12 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.129999999999995 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.637 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.519999999999996 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.230000000000004 111.276 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.140000000000001 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.230000000000004 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.535 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.420000000000002 111.118 174.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.049999999999997 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.510000000000005 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.519999999999996 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.230000000000004 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.230000000000004 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 72.209999999999994 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.310000000000002 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.010000000000005 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.402 ' HA ' ' HE1' ' A' ' 36' ' ' MET . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 74.239999999999995 111.835 176.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 74.439999999999998 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 63.149999999999999 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.402 ' HE1' ' HA ' ' A' ' 33' ' ' PRO . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 73.230000000000004 109.644 -176.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.230000000000004 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 75.040000000000006 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.535 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 73.150000000000006 110.615 167.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.444 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.129999999999995 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 72.150000000000006 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.587 HD11 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 72.209999999999994 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 73.319999999999993 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.551 ' HG3' HG12 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 74.120000000000005 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.501 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 75.019999999999996 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.420000000000002 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.439999999999998 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.501 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.209999999999994 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.571 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.209999999999994 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.219999999999999 111.707 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.484 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 74.040000000000006 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.406 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.409999999999997 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.019999999999996 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.099999999999994 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.587 HH21 HD11 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.140000000000001 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.430000000000007 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.340000000000003 110.93 176.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.140000000000001 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.510000000000005 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 73.530000000000001 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.569 ' HB3' ' HZ3' ' A' ' 62' ' ' LYS . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.510000000000005 110.282 -175.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 75.450000000000003 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.209999999999994 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.420000000000002 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.448 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.540000000000006 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 74.329999999999998 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.435 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.340000000000003 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 54.100000000000001 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 74.010000000000005 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 71.510000000000005 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.430000000000007 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.443 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.530000000000001 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 72.450000000000003 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.150000000000006 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.568 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 72.109999999999999 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.672 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 72.230000000000004 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.340000000000003 110.676 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.422 ' HB2' ' HB1' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 74.219999999999999 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.571 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.672 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.209999999999994 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.219999999999999 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.239999999999995 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 71.019999999999996 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.140000000000001 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.530000000000001 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 71.420000000000002 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.200000000000003 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 74.010000000000005 111.101 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.443 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.030000000000001 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.549999999999997 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.239999999999995 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.448 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 71.140000000000001 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 72.219999999999999 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.099999999999994 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 73.409999999999997 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.319999999999993 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 74.420000000000002 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.422 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.310000000000002 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.329999999999998 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.319999999999993 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 74.530000000000001 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 74.099999999999994 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.462 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 71.420000000000002 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.420000000000002 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 62.439999999999998 109.604 -178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.462 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 74.049999999999997 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.510000000000005 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.554 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.530000000000001 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.494 ' HB2' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.519999999999996 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.7 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.409999999999997 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.209999999999994 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 74.109999999999999 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 74.329999999999998 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.552 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.329999999999998 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.520000000000003 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.7 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 63.439999999999998 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 74.219999999999999 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.319999999999993 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 64.040000000000006 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 71.310000000000002 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 74.230000000000004 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 72.109999999999999 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.310000000000002 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.209999999999994 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 75.129999999999995 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 74.409999999999997 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 74.310000000000002 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.140000000000001 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.319999999999993 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 74.420000000000002 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 72.0 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.875 -0.787 . . . . 74.120000000000005 108.875 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.72 -76.4 0.37 Allowed Glycine 0 C--N 1.352 1.432 0 O-C-N 123.586 0.554 . . . . 62.119999999999997 112.975 -175.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 63.31 22.55 13.37 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 124.272 1.029 . . . . 75.239999999999995 111.929 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -88.77 -21.02 24.02 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.925 0.89 . . . . 71.140000000000001 109.982 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -96.63 113.74 25.33 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.641 0.776 . . . . 73.400000000000006 109.76 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -125.88 116.86 22.2 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.463 0.705 . . . . 73.340000000000003 110.666 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -123.73 4.71 8.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.851 0.861 . . . . 74.239999999999995 110.788 173.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.95 120.94 22.09 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 75.010000000000005 108.841 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.401 ' OG ' ' HA ' ' A' ' 13' ' ' PRO . 13.6 t -166.2 174.93 8.75 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 123.912 0.757 . . . . 73.349999999999994 110.848 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -112.04 -175.92 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.938 1.295 . . . . 73.349999999999994 109.795 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -50.99 -40.61 58.39 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 124.014 0.926 . . . . 70.510000000000005 112.942 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -104.71 99.92 20.82 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 107.92 -1.141 . . . . 75.209999999999994 107.92 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 36.1 Cg_exo -60.13 -36.31 89.3 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.738 2.292 . . . . 74.409999999999997 113.425 -172.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.514 ' HB3' HD22 ' A' ' 17' ' ' LEU . 12.0 t70 -161.33 124.94 3.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.944 0.777 . . . . 74.25 110.154 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.42 HD11 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.98 -33.35 74.15 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.335 0.654 . . . . 74.109999999999999 110.837 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 61.25 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.656 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 74.140000000000001 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.319999999999993 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.516 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 73.450000000000003 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 74.299999999999997 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.417 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 75.25 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 61.32 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 73.329999999999998 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.417 ' ND2' ' HA ' ' A' ' 21' ' ' ASN . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 65.430000000000007 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.319999999999993 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 52.399999999999999 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' A' ' 35' ' ' ALA . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.519999999999996 110.253 173.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 73.010000000000005 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.519999999999996 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 55.219999999999999 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 74.510000000000005 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.541 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.340000000000003 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.541 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 73.340000000000003 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.530000000000001 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' PHE . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 70.109999999999999 110.795 176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.329999999999998 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 74.209999999999994 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.400000000000006 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.403 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.44 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.409999999999997 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.140000000000001 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.462 ' HB3' HD12 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.450000000000003 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.488 HG13 HD11 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 70.25 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.409999999999997 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.409999999999997 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 64.010000000000005 111.922 -178.185 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.219999999999999 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD11 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 75.129999999999995 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 74.430000000000007 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.638 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.099999999999994 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 74.25 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.488 HD11 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 73.519999999999996 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.219999999999999 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.416 ' HA ' ' HB1' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.150000000000006 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.416 ' HB1' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 64.219999999999999 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 73.099999999999994 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.209999999999994 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.219999999999999 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 74.450000000000003 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 72.430000000000007 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.497 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 74.549999999999997 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 64.430000000000007 112.376 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.019999999999996 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.449 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 74.450000000000003 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 74.230000000000004 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.310000000000002 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 71.200000000000003 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.492 HD12 ' HE2' ' A' ' 97' ' ' MET . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 74.230000000000004 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.230000000000004 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.230000000000004 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.66 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 73.439999999999998 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 75.010000000000005 111.897 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 74.200000000000003 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.66 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.349999999999994 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.412 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.150000000000006 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.219999999999999 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.414 HD11 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 74.109999999999999 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.638 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 53.399999999999999 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.412 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 74.150000000000006 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 73.329999999999998 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.427 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 75.519999999999996 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.209999999999994 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.427 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 74.109999999999999 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' ' HB1' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.428 ' HB ' ' HB1' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 74.519999999999996 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.519999999999996 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.200000000000003 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.452 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.140000000000001 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 74.329999999999998 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.430000000000007 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.476 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.329999999999998 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 62.299999999999997 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.492 ' HE2' HD12 ' A' ' 70' ' ' LEU . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.319999999999993 111.135 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.239999999999995 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.299999999999997 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 75.040000000000006 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 65.230000000000004 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG22 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.109999999999999 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.310000000000002 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 65.049999999999997 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.239999999999995 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.452 ' HB ' ' HB3' ' A' ' 91' ' ' ALA . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.549999999999997 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.543 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 63.310000000000002 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 75.329999999999998 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.496 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 75.430000000000007 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.622 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.149999999999999 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.439999999999998 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 74.310000000000002 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.496 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.209999999999994 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.413 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 73.230000000000004 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 75.140000000000001 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.120000000000005 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.129999999999995 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.329999999999998 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.458 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 71.319999999999993 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 75.540000000000006 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 72.400000000000006 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.433 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.230000000000004 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.230000000000004 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.530000000000001 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.433 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 70.109999999999999 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.543 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.409999999999997 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 73.540000000000006 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.530000000000001 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 72.319999999999993 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.010000000000005 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.209999999999994 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.8 m120 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.450000000000003 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 110.423 -0.214 . . . . 71.129999999999995 110.423 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.97 65.75 3.43 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 120.923 0.18 . . . . 64.230000000000004 113.455 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -85.47 -20.0 30.4 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.899 0.48 . . . . 74.430000000000007 110.82 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -74.92 -18.47 60.4 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.679 0.791 . . . . 71.209999999999994 111.966 -174.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -60.15 116.1 3.96 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.748 0.819 . . . . 74.310000000000002 111.03 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -98.21 110.03 22.68 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.503 0.668 . . . . 75.319999999999993 110.28 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -76.0 153.67 36.34 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.016 -1.105 . . . . 72.299999999999997 108.016 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -46.32 111.38 0.36 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.08 0.952 . . . . 62.420000000000002 112.419 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 t -115.12 -178.9 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.005 1.322 . . . . 72.219999999999999 109.4 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -83.63 -169.61 2.65 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.312 0.645 . . . . 73.329999999999998 110.252 171.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 84.3 mtp -54.97 -31.77 61.04 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.781 0.832 . . . . 75.310000000000002 112.012 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -76.43 112.94 24.38 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.004 0.522 . . . . 54.530000000000001 109.627 174.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -70.48 -37.67 7.15 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 122.744 2.296 . . . . 70.420000000000002 112.305 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -158.89 116.22 2.79 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.424 -0.807 . . . . 73.0 109.352 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.409 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -62.9 -28.84 70.33 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.259 0.624 . . . . 73.319999999999993 110.756 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.239999999999995 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.593 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.549999999999997 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.439999999999998 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.536 HG12 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 70.209999999999994 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.593 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.530000000000001 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.555 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 75.400000000000006 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.450000000000003 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.430000000000007 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.555 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.340000000000003 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.439999999999998 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.420000000000002 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 75.299999999999997 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 75.219999999999999 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 71.349999999999994 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.597 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.310000000000002 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.477 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 74.099999999999994 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.478 ' HA ' ' HE2' ' A' ' 36' ' ' MET . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.597 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.509999999999998 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.409999999999997 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.546 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.329999999999998 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.430000000000007 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 74.219999999999999 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.030000000000001 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.421 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 72.239999999999995 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.299999999999997 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 61.310000000000002 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.200000000000003 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 72.420000000000002 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HG3' HG12 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 73.010000000000005 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.329999999999998 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 63.32 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 74.040000000000006 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 65.040000000000006 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB2' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 72.430000000000007 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.420000000000002 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 72.310000000000002 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 64.340000000000003 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.430000000000007 114.494 -171.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 74.420000000000002 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 74.140000000000001 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 74.530000000000001 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.450000000000003 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 74.150000000000006 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.546 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 75.109999999999999 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.409999999999997 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.340000000000003 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.209999999999994 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 74.099999999999994 111.213 -177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.310000000000002 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.040000000000006 112.741 -174.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.109999999999999 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 61.119999999999997 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 63.240000000000002 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.521 ' HZ1' ' HB2' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.209999999999994 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.219999999999999 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.589 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.230000000000004 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 75.129999999999995 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.439999999999998 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.66 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 71.329999999999998 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.420000000000002 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.510000000000005 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 75.310000000000002 109.911 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.349999999999994 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.239999999999995 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.299999999999997 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 74.239999999999995 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.540000000000006 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.219999999999999 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 54.049999999999997 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 74.140000000000001 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.239999999999995 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 71.040000000000006 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.589 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.120000000000005 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.531 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.099999999999994 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 65.310000000000002 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 75.409999999999997 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.471 HD23 ' HZ2' ' A' ' 90' ' ' LYS . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 73.019999999999996 111.403 177.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.340000000000003 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.209999999999994 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.430000000000007 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.340000000000003 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.519999999999996 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.450000000000003 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 71.549999999999997 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.340000000000003 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.592 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.530000000000001 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.119999999999997 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.531 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.530000000000001 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 72.409999999999997 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.340000000000003 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.486 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.129999999999995 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.540000000000006 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.319999999999993 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 74.209999999999994 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.239999999999995 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.439999999999998 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 73.540000000000006 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.486 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 73.019999999999996 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 74.109999999999999 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 71.209999999999994 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 74.519999999999996 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 70.239999999999995 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.030000000000001 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.120000000000005 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 71.340000000000003 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.209999999999994 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.519999999999996 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 70.209999999999994 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 74.430000000000007 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 72.299999999999997 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 74.319999999999993 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 75.420000000000002 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 70.340000000000003 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.510000000000005 109.551 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.128 -0.323 . . . . 64.409999999999997 110.128 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.46 55.44 0.08 OUTLIER Glycine 0 C--N 1.348 1.195 0 CA-C-N 116.444 -0.343 . . . . 65.549999999999997 112.908 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -128.15 130.55 48.26 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.399 -0.963 . . . . 73.329999999999998 108.399 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 71.51 7.2 5.95 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.343 1.457 . . . . 73.430000000000007 111.038 -174.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -71.89 136.85 47.07 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.443 0.697 . . . . 74.409999999999997 110.224 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -157.76 136.97 11.75 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.822 -0.807 . . . . 75.219999999999999 108.822 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -67.19 92.48 0.26 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.656 0.741 . . . . 73.239999999999995 110.014 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -91.14 170.96 9.59 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.431 -1.259 . . . . 71.510000000000005 110.896 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.5 m -78.34 -175.26 4.13 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.985 0.914 . . . . 60.439999999999998 112.177 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -54.62 109.68 0.53 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.304 1.841 . . . . 72.150000000000006 111.881 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.42 -71.48 0.47 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 110.325 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -62.51 114.22 11.32 Favored Pre-proline 0 C--N 1.354 0.801 0 O-C-N 124.114 0.884 . . . . 74.430000000000007 109.199 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -55.3 -30.97 74.75 Favored 'Trans proline' 0 C--N 1.382 2.307 0 C-N-CA 123.555 2.837 . . . . 75.019999999999996 112.707 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.516 ' HB3' HD23 ' A' ' 17' ' ' LEU . 23.4 t70 -159.55 111.4 2.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.654 0.782 . . . . 72.530000000000001 109.072 172.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.4 -30.99 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.301 0.64 . . . . 74.340000000000003 111.5 -178.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.439999999999998 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 75.340000000000003 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 75.239999999999995 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.519999999999996 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.439999999999998 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.209999999999994 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.46 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 72.319999999999993 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 65.409999999999997 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.442 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 0.9 OUTLIER -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 73.010000000000005 111.111 177.833 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 74.010000000000005 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.130000000000003 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.319999999999993 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.010000000000005 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 75.200000000000003 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.430000000000007 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 71.129999999999995 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.409999999999997 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.340000000000003 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.555 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 72.010000000000005 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.210000000000001 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.666 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.239999999999995 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.150000000000006 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.310000000000002 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.442 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.340000000000003 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.340000000000003 109.879 -179.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.430000000000007 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.209999999999994 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.409999999999997 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 73.150000000000006 111.492 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 74.510000000000005 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.420000000000002 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 71.209999999999994 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.140000000000001 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.54 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.310000000000002 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.462 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.430000000000007 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 73.409999999999997 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.594 HD22 ' HZ2' ' A' ' 20' ' ' LYS . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 71.230000000000004 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 74.439999999999998 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.219999999999999 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.540000000000006 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.666 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.439999999999998 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.140000000000001 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.540000000000006 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 73.439999999999998 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.510000000000005 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 73.019999999999996 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 71.049999999999997 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 74.340000000000003 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 75.310000000000002 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 72.310000000000002 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 64.200000000000003 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 70.310000000000002 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.409999999999997 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 75.439999999999998 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 74.430000000000007 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.51 ' HB3' ' HZ3' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.439999999999998 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.120000000000005 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.567 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 74.150000000000006 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.540000000000006 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.150000000000006 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.462 ' SG ' ' HB3' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.230000000000004 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.497 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 74.129999999999995 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.519999999999996 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.140000000000001 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.405 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 74.400000000000006 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.497 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 75.040000000000006 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 71.209999999999994 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.400000000000006 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.451 HG23 ' HB2' ' A' ' 117' ' ' CYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 72.549999999999997 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.438 ' HD2' ' HB ' ' A' ' 84' ' ' ILE . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.539999999999999 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.430000000000007 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 75.430000000000007 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 63.509999999999998 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.530000000000001 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.567 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.219999999999999 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.484 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.200000000000003 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 60.340000000000003 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.415 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 75.019999999999996 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.030000000000001 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.209999999999994 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 73.150000000000006 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.219999999999999 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 74.040000000000006 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.209999999999994 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 64.310000000000002 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.129999999999995 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.109999999999999 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.559 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.340000000000003 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.459 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 72.409999999999997 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.049999999999997 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.484 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 73.519999999999996 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.299999999999997 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 74.439999999999998 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.540000000000006 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.534 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 62.130000000000003 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 74.239999999999995 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.209999999999994 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.420000000000002 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.53 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 71.540000000000006 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 73.340000000000003 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.319999999999993 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 73.239999999999995 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 64.409999999999997 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.329999999999998 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 74.530000000000001 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 74.129999999999995 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 71.409999999999997 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.459 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.209999999999994 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 72.120000000000005 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 73.420000000000002 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 70.540000000000006 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 71.329999999999998 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.129999999999995 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 74.510000000000005 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.420000000000002 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 74.299999999999997 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.209999999999994 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 110.742 -0.096 . . . . 72.540000000000006 110.742 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.23 78.41 0.96 Allowed Glycine 0 C--N 1.351 1.381 0 C-N-CA 123.072 0.367 . . . . 62.32 113.675 -172.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -98.35 111.74 23.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.429 0.692 . . . . 71.400000000000006 110.49 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -85.21 -32.0 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.76 0.824 . . . . 71.329999999999998 109.668 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -78.47 117.54 19.77 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.437 -0.949 . . . . 73.329999999999998 108.437 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -94.04 157.58 16.03 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.518 0.727 . . . . 70.109999999999999 110.805 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -61.9 137.47 58.25 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.842 0.857 . . . . 64.019999999999996 110.495 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.6 m80 -83.0 68.25 9.42 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.748 0.819 . . . . 74.040000000000006 110.131 -177.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.9 t -111.42 42.32 1.7 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.662 0.744 . . . . 72.129999999999995 109.174 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -148.61 133.71 18.25 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 107.994 -1.113 . . . . 74.430000000000007 107.994 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.7 mtm -62.5 -31.26 71.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.306 0.642 . . . . 71.120000000000005 111.615 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -125.88 91.7 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.356 1.063 . . . . 64.439999999999998 108.423 169.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.11 -41.76 72.86 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.86 2.373 . . . . 75.109999999999999 112.383 -176.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -167.76 112.68 0.68 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.576 -0.898 . . . . 73.409999999999997 108.576 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.411 ' H ' HD11 ' A' ' 15' ' ' LEU . 5.2 mp -61.5 -31.29 71.27 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 75.319999999999993 110.386 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.421 ' HB1' ' HB3' ' A' ' 45' ' ' ARG . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 74.030000000000001 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.578 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.439999999999998 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 55.130000000000003 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.597 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.329999999999998 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 71.319999999999993 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.530000000000001 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 74.030000000000001 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 63.219999999999999 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.209999999999994 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.340000000000003 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 73.420000000000002 111.655 -178.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.439999999999998 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.040000000000006 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.010000000000005 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.310000000000002 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.421 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.239999999999995 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.421 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.140000000000001 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 74.230000000000004 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.049999999999997 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 73.25 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 75.299999999999997 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.430000000000007 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 73.310000000000002 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 73.299999999999997 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 65.129999999999995 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.040000000000006 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.209999999999994 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.597 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.120000000000005 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.43 HD22 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 73.0 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.209999999999994 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HA ' HD23 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 73.319999999999993 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.420000000000002 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.509999999999998 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 72.019999999999996 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.494 HD23 ' HZ2' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.150000000000006 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.648 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.209999999999994 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.299999999999997 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 73.150000000000006 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 74.209999999999994 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.140000000000001 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 73.129999999999995 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.239999999999995 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.239999999999995 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.420000000000002 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.526 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 74.540000000000006 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 74.430000000000007 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.230000000000004 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.409999999999997 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.319999999999993 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.530000000000001 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.040000000000006 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.340000000000003 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.549 HD13 ' HE1' ' A' ' 97' ' ' MET . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.040000000000006 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.150000000000006 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.019999999999996 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.209999999999994 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.209999999999994 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.130000000000003 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 74.209999999999994 110.392 178.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.439999999999998 111.156 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 71.030000000000001 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.120000000000005 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.230000000000004 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.471 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.230000000000004 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 71.120000000000005 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.439999999999998 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.471 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 64.519999999999996 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.120000000000005 111.304 173.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.599 HG23 ' HB1' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 72.209999999999994 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.419 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.510000000000005 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.435 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.099999999999994 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 65.319999999999993 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.319999999999993 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 72.420000000000002 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.319999999999993 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 75.420000000000002 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.430000000000007 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.549 ' HE1' HD13 ' A' ' 70' ' ' LEU . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.420000000000002 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.030000000000001 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.431 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 73.200000000000003 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 74.450000000000003 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.420000000000002 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 52.310000000000002 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.408 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.109999999999999 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.420000000000002 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 74.530000000000001 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.425 ' HD1' ' HB2' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.340000000000003 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 72.239999999999995 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 74.040000000000006 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.64 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.409999999999997 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.340000000000003 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.467 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.519999999999996 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.430000000000007 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.019999999999996 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.140000000000001 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.329999999999998 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.64 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 72.430000000000007 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 74.510000000000005 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.120000000000005 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.599 ' HB1' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.219999999999999 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 75.439999999999998 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.129999999999995 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.420000000000002 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.408 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 75.109999999999999 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 70.329999999999998 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 74.219999999999999 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.340000000000003 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 75.040000000000006 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.439999999999998 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.349999999999994 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.431 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.519999999999996 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.209999999999994 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.6 m120 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.439999999999998 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 110.463 -0.199 . . . . 74.549999999999997 110.463 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.77 108.8 0.39 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.944 -0.862 . . . . 73.209999999999994 110.944 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -65.29 119.98 11.92 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.286 0.634 . . . . 72.439999999999998 109.562 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -75.25 100.34 4.31 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.222 0.534 . . . . 71.439999999999998 109.689 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -128.53 162.73 26.55 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 125.007 1.323 . . . . 73.340000000000003 108.791 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -58.13 127.85 34.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.593 0.757 . . . . 72.239999999999995 110.524 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -67.99 156.46 37.26 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.187 0.595 . . . . 74.099999999999994 111.539 -170.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -81.86 162.69 22.71 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.185 0.994 . . . . 74.010000000000005 109.99 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 t -70.04 165.32 22.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.047 0.539 . . . . 70.140000000000001 110.498 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -73.78 78.08 1.58 Allowed 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.678 0.791 . . . . 75.040000000000006 111.803 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.1 mmm -71.87 -48.78 43.48 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.328 -0.99 . . . . 74.340000000000003 108.328 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -69.59 131.78 89.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 114.494 -1.23 . . . . 74.109999999999999 108.634 163.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.0 -46.62 32.62 Favored 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 123.117 2.545 . . . . 74.209999999999994 113.022 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.514 ' HB3' HD23 ' A' ' 17' ' ' LEU . 33.6 t70 -163.46 114.55 1.4 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.543 0.337 . . . . 53.549999999999997 110.507 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.441 HD11 ' H ' ' A' ' 15' ' ' LEU . 4.0 mp -61.69 -36.14 80.04 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.716 0.807 . . . . 74.109999999999999 109.92 -176.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.430000000000007 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.616 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 74.099999999999994 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.530000000000001 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.531 HG13 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 64.129999999999995 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.616 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.530000000000001 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 72.099999999999994 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 75.209999999999994 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.219999999999999 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 74.340000000000003 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.515 ' SG ' ' HD2' ' A' ' 38' ' ' HIS . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.130000000000003 111.487 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.299999999999997 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.319999999999993 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 72.319999999999993 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 62.109999999999999 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.515 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 73.109999999999999 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 74.140000000000001 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.129999999999995 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.200000000000003 111.36 179.16 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 73.120000000000005 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.420000000000002 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 73.430000000000007 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.515 ' HD2' ' SG ' ' A' ' 26' ' ' CYS . 23.1 m-70 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.340000000000003 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.340000000000003 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.099999999999994 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.049999999999997 110.259 173.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 74.420000000000002 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.329999999999998 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 63.130000000000003 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.531 ' HG3' HG13 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.329999999999998 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 74.430000000000007 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 73.219999999999999 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.510000000000005 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 62.119999999999997 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.632 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 74.239999999999995 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.603 ' HZ1' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.319999999999993 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.522 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 73.109999999999999 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.350000000000001 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 75.129999999999995 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 74.120000000000005 110.139 178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 65.439999999999998 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.310000000000002 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 74.040000000000006 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.219999999999999 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.439999999999998 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 70.209999999999994 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.530000000000001 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.239999999999995 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.519999999999996 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 71.409999999999997 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.319999999999993 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.340000000000003 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 75.219999999999999 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.539 HD12 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 73.140000000000001 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.510000000000005 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 73.140000000000001 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.510000000000005 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 65.0 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.540000000000006 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.597 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 74.200000000000003 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.442 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.150000000000006 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.409999999999997 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.515 ' HB2' ' HB1' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 64.219999999999999 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.632 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.442 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.409999999999997 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 74.109999999999999 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.340000000000003 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.678 HG22 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 73.239999999999995 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 73.310000000000002 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.430000000000007 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.409999999999997 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 74.049999999999997 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.049999999999997 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 71.420000000000002 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.310000000000002 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.049999999999997 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 73.299999999999997 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.518 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 65.019999999999996 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.400000000000006 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.310000000000002 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.539 ' HG3' HD12 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 74.430000000000007 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.329999999999998 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.349999999999994 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.448 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.040000000000006 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.504 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.439999999999998 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.518 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 72.219999999999999 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.458 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 64.329999999999998 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.504 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 75.230000000000004 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.099999999999994 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 74.109999999999999 110.807 -171.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.019999999999996 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.340000000000003 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 74.230000000000004 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.704 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 54.399999999999999 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.140000000000001 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.140000000000001 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.120000000000005 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.150000000000006 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.408 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 65.239999999999995 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.510000000000005 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.319999999999993 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.549999999999997 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.439999999999998 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.409999999999997 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 52.399999999999999 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.230000000000004 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.530000000000001 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.430000000000007 110.737 173.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.439999999999998 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.099999999999994 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 103' ' ' ALA . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 75.239999999999995 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 74.040000000000006 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.420000000000002 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.219999999999999 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.461 ' NE2' ' HE1' ' A' ' 104' ' ' MET . 9.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 72.019999999999996 111.757 174.315 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 73.25 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.219999999999999 109.075 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.338 -0.245 . . . . 74.239999999999995 110.338 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.47 49.33 8.25 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.543 -0.623 . . . . 74.310000000000002 111.543 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -77.38 135.7 38.36 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.461 0.704 . . . . 72.209999999999994 110.075 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -110.52 160.41 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.583 0.753 . . . . 71.230000000000004 110.684 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -118.73 39.31 3.53 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 107.299 -1.371 . . . . 63.329999999999998 107.299 169.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 m80 73.54 -52.12 0.7 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.968 1.707 . . . . 72.340000000000003 111.873 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 t60 62.01 27.86 16.88 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.568 1.147 . . . . 74.400000000000006 110.028 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -67.73 88.53 0.24 Allowed 'General case' 0 C--N 1.353 0.759 0 C-N-CA 124.428 1.091 . . . . 72.519999999999996 109.707 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -152.87 165.52 35.2 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-N 114.142 -1.39 . . . . 74.439999999999998 108.604 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.98 150.39 5.59 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.751 0.82 . . . . 74.209999999999994 110.727 167.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -46.51 -37.97 8.64 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 124.956 1.302 . . . . 73.310000000000002 113.303 -171.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -99.77 95.81 4.12 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 107.469 -1.308 . . . . 72.230000000000004 107.469 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -61.28 -32.85 90.36 Favored 'Trans proline' 0 C--N 1.381 2.266 0 C-N-CA 122.893 2.395 . . . . 72.430000000000007 112.569 -171.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.541 ' HB3' HD23 ' A' ' 17' ' ' LEU . 31.5 t70 -151.54 105.77 3.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 114.86 -1.063 . . . . 64.439999999999998 108.711 -175.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -67.29 -21.85 65.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.851 0.461 . . . . 73.450000000000003 110.766 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.049999999999997 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.702 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.549999999999997 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.540000000000006 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.551 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.109999999999999 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.702 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.430000000000007 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.510000000000005 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.419 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 74.400000000000006 110.395 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 70.120000000000005 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.340000000000003 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.420000000000002 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.030000000000001 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 72.450000000000003 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 75.530000000000001 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 74.329999999999998 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 75.129999999999995 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.530000000000001 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.530000000000001 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.230000000000004 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.439999999999998 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.539999999999999 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.120000000000005 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.310000000000002 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.458 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 78.7 m-70 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.299999999999997 109.205 173.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 75.150000000000006 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 74.340000000000003 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.540000000000006 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.129999999999995 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 72.209999999999994 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 75.120000000000005 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.551 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 72.310000000000002 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 73.329999999999998 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.120000000000005 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.019999999999996 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB3' HD22 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.540000000000006 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.540000000000006 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 74.040000000000006 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.53 HD22 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 74.439999999999998 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.420000000000002 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.109999999999999 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.129999999999995 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 72.219999999999999 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 74.0 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 72.019999999999996 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.109999999999999 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 73.530000000000001 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.510000000000005 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.540000000000006 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 74.319999999999993 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 73.409999999999997 112.096 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 73.409999999999997 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 73.030000000000001 112.446 -177.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 74.299999999999997 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 74.329999999999998 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 72.040000000000006 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.501 HD13 ' HE2' ' A' ' 97' ' ' MET . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 75.209999999999994 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 75.349999999999994 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 75.209999999999994 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.030000000000001 111.206 173.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 73.530000000000001 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.219999999999999 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.430000000000007 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 72.329999999999998 110.312 173.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.439999999999998 109.71 -177.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.030000000000001 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.329999999999998 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 72.310000000000002 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 72.129999999999995 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.439999999999998 110.087 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.299999999999997 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.434 ' N ' ' HD2' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.299999999999997 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.219999999999999 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.299999999999997 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.467 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 64.140000000000001 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.150000000000006 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 73.439999999999998 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.299999999999997 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 43.32 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 71.340000000000003 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.340000000000003 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.219999999999999 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 71.150000000000006 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.501 ' HE2' HD13 ' A' ' 70' ' ' LEU . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.430000000000007 110.414 175.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 73.239999999999995 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.109999999999999 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 75.349999999999994 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.419 ' O ' HG21 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.120000000000005 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 73.040000000000006 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 71.430000000000007 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.240000000000002 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 72.519999999999996 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 75.5 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 73.120000000000005 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.340000000000003 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.439999999999998 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.778 HD21 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.319999999999993 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.340000000000003 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 72.409999999999997 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.310000000000002 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.230000000000004 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 70.049999999999997 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.778 ' SG ' HD21 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.030000000000001 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.409999999999997 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.467 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.409999999999997 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.019999999999996 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.099999999999994 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.140000000000001 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 70.140000000000001 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 74.329999999999998 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.430000000000007 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 63.409999999999997 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.319999999999993 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 74.310000000000002 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.209999999999994 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.430000000000007 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 70.219999999999999 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.019999999999996 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 109.694 -0.484 . . . . 74.230000000000004 109.694 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 37.23 3.03 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.292 -0.413 . . . . 72.530000000000001 112.833 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 m170 -73.54 114.18 11.49 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 109.501 -0.555 . . . . 74.219999999999999 109.501 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -74.81 77.7 2.1 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.948 0.899 . . . . 65.310000000000002 109.15 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -128.97 5.99 5.43 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.29 1.036 . . . . 71.409999999999997 109.507 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -75.96 90.16 2.98 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.771 0.829 . . . . 74.310000000000002 109.974 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -97.72 -48.46 5.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.494 -0.775 . . . . 74.540000000000006 109.275 172.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.61 150.41 44.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.228 1.011 . . . . 74.319999999999993 109.001 -177.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.1 t -161.58 175.7 11.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.996 0.426 . . . . 71.319999999999993 110.573 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -71.97 171.47 11.77 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.85 0.86 . . . . 74.450000000000003 111.38 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 mtt -55.62 -50.65 69.58 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.097 0.959 . . . . 74.099999999999994 109.952 -178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.507 HD21 ' HE2' ' A' ' 18' ' ' MET . 17.7 m120 -133.72 100.16 13.65 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 106.62 -1.622 . . . . 74.340000000000003 106.62 166.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.33 -33.01 95.42 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 122.366 2.044 . . . . 63.020000000000003 111.056 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.521 ' HB3' HD22 ' A' ' 17' ' ' LEU . 20.1 t70 -153.79 108.16 3.07 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 107.543 -1.281 . . . . 71.349999999999994 107.543 175.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.402 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.4 mp -57.5 -31.39 65.98 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.394 0.677 . . . . 74.140000000000001 110.207 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.602 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 73.5 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.507 ' HE2' HD21 ' A' ' 12' ' ' ASN . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 74.430000000000007 110.578 -176.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.474 HG13 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 73.299999999999997 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.602 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 71.310000000000002 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 71.510000000000005 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 72.219999999999999 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.319999999999993 114.04 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 71.409999999999997 112.282 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.409999999999997 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 75.129999999999995 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.488 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.040000000000006 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.230000000000004 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 73.209999999999994 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.439999999999998 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 73.420000000000002 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 72.219999999999999 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.631 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 37.7 mm-40 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.209999999999994 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.400000000000006 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.099999999999994 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 75.209999999999994 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 74.200000000000003 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.510000000000005 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.140000000000001 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.109999999999999 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 73.519999999999996 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 73.430000000000007 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 63.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HG3' HG13 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.430000000000007 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.439999999999998 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.040000000000006 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.329999999999998 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.040000000000006 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 72.25 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.459 HD22 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 74.230000000000004 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.129999999999995 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.010000000000005 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 72.340000000000003 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 73.120000000000005 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 73.230000000000004 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 75.109999999999999 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.400000000000006 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.530000000000001 111.841 -174.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.488 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.109999999999999 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 64.239999999999995 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.329999999999998 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 74.329999999999998 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 73.409999999999997 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.399999999999999 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.329999999999998 111.887 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 75.420000000000002 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.530000000000001 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.420000000000002 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.340000000000003 111.248 176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.030000000000001 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.409999999999997 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 73.349999999999994 110.49 178.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.239999999999995 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 73.010000000000005 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 74.409999999999997 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 72.400000000000006 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.230000000000004 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.040000000000006 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.594 HG21 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.549999999999997 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.420000000000002 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 62.509999999999998 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.099999999999994 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.465 HG21 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 74.510000000000005 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.465 HH21 HG21 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.420000000000002 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 73.120000000000005 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.455 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.120000000000005 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.450000000000003 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.040000000000006 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.430000000000007 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.140000000000001 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.420000000000002 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.340000000000003 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.340000000000003 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 74.319999999999993 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 74.209999999999994 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.406 ' O ' HG22 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 75.0 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 72.25 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 75.299999999999997 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.455 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 75.099999999999994 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.627 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.450000000000003 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.430000000000007 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.545 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.519999999999996 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.559 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.439999999999998 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.239999999999995 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.439999999999998 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 73.219999999999999 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.040000000000006 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.488 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.230000000000004 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.594 ' SG ' HG21 ' A' ' 84' ' ' ILE . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 74.150000000000006 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.488 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 74.049999999999997 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.340000000000003 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.465 ' HB2' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 72.439999999999998 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.452 ' HB2' HD23 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.310000000000002 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.200000000000003 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 72.010000000000005 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.230000000000004 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.409999999999997 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 73.299999999999997 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.627 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.150000000000006 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 75.450000000000003 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 72.019999999999996 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 73.109999999999999 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.439999999999998 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.219999999999999 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtt . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.693 -0.484 . . . . 75.239999999999995 109.693 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.86 57.79 7.51 Favored Glycine 0 C--N 1.351 1.414 0 O-C-N 123.529 0.518 . . . . 65.120000000000005 112.607 178.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -73.99 145.31 44.7 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.435 0.694 . . . . 73.329999999999998 109.505 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 59.04 60.48 2.41 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 108.401 -0.963 . . . . 74.420000000000002 108.401 -161.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -76.33 89.77 3.18 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.547 -1.206 . . . . 75.400000000000006 109.834 -174.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -66.72 99.33 0.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.721 0.808 . . . . 72.150000000000006 110.648 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -137.14 81.77 1.89 Allowed 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.865 0.866 . . . . 73.530000000000001 109.061 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.4 m80 -137.79 -160.21 1.04 Allowed 'General case' 0 C--O 1.245 0.842 0 N-CA-C 106.895 -1.52 . . . . 75.329999999999998 106.895 171.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -65.82 82.72 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 109.389 -0.597 . . . . 70.439999999999998 109.389 170.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -74.01 99.11 3.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.158 0.983 . . . . 63.340000000000003 110.894 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 mtm -59.6 -38.49 81.39 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.016 -0.993 . . . . 74.219999999999999 110.516 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -70.11 109.89 5.69 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 108.126 -1.065 . . . . 74.030000000000001 108.126 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -56.94 -41.05 79.41 Favored 'Trans proline' 0 C--N 1.377 2.064 0 C-N-CA 123.08 2.52 . . . . 72.329999999999998 112.033 -177.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.503 ' HB3' HD23 ' A' ' 17' ' ' LEU . 17.6 t70 -162.35 112.72 1.52 Allowed 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.202 -1.036 . . . . 73.340000000000003 108.202 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp -60.25 -30.72 69.61 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.246 0.618 . . . . 75.549999999999997 111.076 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.41 ' HA ' ' HB3' ' A' ' 45' ' ' ARG . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.140000000000001 112.945 177.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.64 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.540000000000006 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 74.319999999999993 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 74.420000000000002 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.64 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.430000000000007 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 74.340000000000003 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.319999999999993 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 71.519999999999996 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.219999999999999 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.555 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.030000000000001 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.019999999999996 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 75.340000000000003 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.140000000000001 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.310000000000002 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.140000000000001 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 75.140000000000001 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.647 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.299999999999997 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.62 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.310000000000002 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 74.230000000000004 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 72.209999999999994 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.62 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.340000000000003 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 74.030000000000001 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 75.209999999999994 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 65.0 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 63.509999999999998 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 74.019999999999996 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.41 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 75.329999999999998 110.505 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.310000000000002 110.961 179.743 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 73.409999999999997 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.530000000000001 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.519 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.340000000000003 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.109999999999999 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.230000000000004 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 74.129999999999995 111.055 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.239999999999995 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.482 ' HG ' ' HG3' ' A' ' 89' ' ' ARG . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.150000000000006 112.777 -178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 54.5 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 72.310000000000002 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.039999999999999 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 71.319999999999993 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 70.310000000000002 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.140000000000001 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.140000000000001 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.310000000000002 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.530000000000001 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.439999999999998 111.808 -179.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.349999999999994 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.455 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 75.040000000000006 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.239999999999995 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 75.230000000000004 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 74.510000000000005 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.494 HD13 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.140000000000001 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 73.25 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.420000000000002 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.517 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 70.040000000000006 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.400000000000006 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 72.299999999999997 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.200000000000003 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.402 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.219999999999999 110.251 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 74' ' ' GLU . 27.7 mm-40 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.150000000000006 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 75.439999999999998 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.329999999999998 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 74.140000000000001 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.450000000000003 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 75.230000000000004 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.319999999999993 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 71.409999999999997 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.319999999999993 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 74.219999999999999 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.482 ' HG3' ' HG ' ' A' ' 54' ' ' SER . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 75.310000000000002 110.03 175.482 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.541 ' HZ2' HD23 ' A' ' 94' ' ' LEU . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.239999999999995 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.420000000000002 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 72.519999999999996 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.439999999999998 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.541 HD23 ' HZ2' ' A' ' 90' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.329999999999998 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 71.25 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 73.439999999999998 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.494 ' HG3' HD13 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 72.129999999999995 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.349999999999994 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 74.219999999999999 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.530000000000001 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.450000000000003 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HB2' HD11 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 72.420000000000002 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.200000000000003 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.239999999999995 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 72.120000000000005 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.140000000000001 109.397 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.030000000000001 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.510000000000005 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.349999999999994 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 75.030000000000001 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 73.219999999999999 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.099999999999994 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.319999999999993 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HB3' HD12 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.329999999999998 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 73.530000000000001 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.219999999999999 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.329999999999998 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.239999999999995 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 74.120000000000005 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 74.129999999999995 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 73.430000000000007 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.310000000000002 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.329999999999998 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.409999999999997 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.415 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 73.209999999999994 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 74.310000000000002 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 65.150000000000006 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.415 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 75.540000000000006 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.129999999999995 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.319999999999993 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.140000000000001 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.420000000000002 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mmt . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.453 -0.573 . . . . 74.319999999999993 109.453 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -136.28 -153.3 6.52 Favored Glycine 0 C--N 1.342 0.887 0 N-CA-C 110.797 -0.921 . . . . 75.540000000000006 110.797 174.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -99.88 141.71 32.33 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 117.152 0.476 . . . . 74.450000000000003 110.999 -177.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -85.47 -16.85 38.27 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 65.420000000000002 110.526 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -64.23 86.59 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.483 0.713 . . . . 75.25 110.276 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -139.16 29.01 2.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.798 1.239 . . . . 71.239999999999995 109.426 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -85.48 46.16 1.27 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.886 0.85 . . . . 75.150000000000006 110.29 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -146.01 34.05 1.01 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.929 1.692 . . . . 73.25 107.572 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 m -64.9 107.39 1.46 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.68 0.792 . . . . 75.209999999999994 110.333 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -75.7 -168.04 0.79 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.124 0.97 . . . . 73.340000000000003 111.151 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -49.28 -49.52 43.21 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.017 0.927 . . . . 72.430000000000007 110.473 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -93.3 111.04 50.26 Favored Pre-proline 0 C--O 1.241 0.608 0 N-CA-C 107.403 -1.332 . . . . 63.340000000000003 107.403 161.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.518 ' HG2' HD21 ' A' ' 17' ' ' LEU . 28.0 Cg_endo -61.28 -30.45 88.02 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 122.446 2.098 . . . . 75.420000000000002 111.837 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' HB3' HD22 ' A' ' 17' ' ' LEU . 20.4 t70 -165.45 118.29 1.17 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.317 0.647 . . . . 74.239999999999995 110.258 173.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.413 HD11 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.23 -34.33 73.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.917 0.887 . . . . 73.299999999999997 110.735 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 72.219999999999999 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.631 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 73.230000000000004 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.119999999999997 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.130000000000003 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.631 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 74.519999999999996 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 72.310000000000002 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.41 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 73.439999999999998 110.448 179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 73.030000000000001 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.544 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 74.420000000000002 110.105 174.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.450000000000003 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.41 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.420000000000002 112.602 179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.329999999999998 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 75.430000000000007 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 72.239999999999995 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.530000000000001 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.452 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.329999999999998 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.437 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.329999999999998 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.030000000000001 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.1 OUTLIER -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 73.040000000000006 111.188 -176.874 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.452 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 74.120000000000005 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.517 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 75.510000000000005 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.209999999999994 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.299999999999997 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.544 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.329999999999998 111.251 167.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.439999999999998 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.319999999999993 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.310000000000002 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 74.420000000000002 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.540000000000006 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.129999999999995 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.049999999999997 111.081 -176.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 73.450000000000003 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 72.430000000000007 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.510000000000005 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.412 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 71.25 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.642 ' HZ3' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 74.109999999999999 110.143 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.030000000000001 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 71.409999999999997 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 73.329999999999998 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.109999999999999 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.517 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 74.329999999999998 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 72.439999999999998 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.229999999999997 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.239999999999995 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 73.510000000000005 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 74.5 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 74.230000000000004 111.575 -177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.299999999999997 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.507 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.430000000000007 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 71.340000000000003 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.402 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.329999999999998 108.964 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 75.329999999999998 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.540000000000006 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HZ1' ' HB3' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 72.530000000000001 112.092 -174.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 72.200000000000003 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.422 ' SG ' ' O ' ' A' ' 70' ' ' LEU . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.019999999999996 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 74.200000000000003 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.209999999999994 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.412 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.109999999999999 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 75.329999999999998 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.319999999999993 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 75.340000000000003 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.319999999999993 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.430000000000007 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 73.409999999999997 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.540000000000006 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.439 HD12 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.230000000000004 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 73.409999999999997 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.219999999999999 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.230000000000004 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.408 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 73.209999999999994 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.408 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.444 ' HZ2' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 75.340000000000003 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 74.129999999999995 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.219999999999999 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.340000000000003 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 75.239999999999995 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.310000000000002 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.540000000000006 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.450000000000003 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.329999999999998 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 62.240000000000002 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.430000000000007 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.299999999999997 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.040000000000006 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 63.549999999999997 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.428 ' HE1' HE22 ' A' ' 131' ' ' GLN . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 72.209999999999994 111.975 -179.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.520000000000003 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.403 HG11 ' HB3' ' A' ' 90' ' ' LYS . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 63.43 110.802 -169.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 75.420000000000002 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 74.310000000000002 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 72.049999999999997 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.340000000000003 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.646 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 73.430000000000007 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.432 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 75.420000000000002 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.329999999999998 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.439 ' HB2' HD12 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 74.109999999999999 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 75.430000000000007 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.340000000000003 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.646 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.430000000000007 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.439999999999998 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 75.340000000000003 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.120000000000005 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.530000000000001 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 63.240000000000002 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.129999999999995 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.150000000000006 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.230000000000004 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 64.430000000000007 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 72.439999999999998 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.140000000000001 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 74.219999999999999 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 72.420000000000002 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.428 HE22 ' HE1' ' A' ' 104' ' ' MET . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.230000000000004 111.224 175.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 74.200000000000003 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.420000000000002 108.681 174.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.4 mtp . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.116 -0.328 . . . . 74.019999999999996 110.116 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.78 24.71 1.17 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 112.526 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -81.87 59.27 4.21 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.646 0.736 . . . . 71.230000000000004 110.436 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -140.03 143.4 36.39 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.647 1.179 . . . . 75.430000000000007 108.125 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -87.39 159.02 18.87 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.967 -0.753 . . . . 74.200000000000003 108.967 169.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -71.14 -157.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.565 0.746 . . . . 73.400000000000006 109.437 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -53.99 155.45 3.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.647 0.379 . . . . 74.200000000000003 111.061 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -54.67 156.89 3.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.486 0.714 . . . . 65.409999999999997 110.803 172.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.2 t -56.47 159.94 3.43 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.37 0.668 . . . . 73.099999999999994 111.51 -178.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -52.12 152.43 3.23 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.539 0.736 . . . . 74.230000000000004 110.861 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -63.31 -14.08 45.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.096 0.958 . . . . 71.040000000000006 113.573 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.23 140.9 83.0 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-O 117.965 -1.017 . . . . 71.129999999999995 109.446 164.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' HD21 ' A' ' 17' ' ' LEU . 9.3 Cg_endo -47.03 -51.76 8.83 Favored 'Trans proline' 0 C--N 1.391 2.791 0 C-N-CA 123.506 2.804 . . . . 75.409999999999997 113.194 -168.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.4 t70 -177.86 128.9 0.14 Allowed 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.8 0.687 . . . . 73.329999999999998 109.984 164.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.32 -30.36 69.45 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.417 0.687 . . . . 75.010000000000005 111.88 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.420000000000002 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 74.439999999999998 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.200000000000003 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 64.030000000000001 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.229999999999997 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.340000000000003 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.120000000000005 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.450000000000003 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.319999999999993 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.457 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.510000000000005 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.310000000000002 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.230000000000004 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 73.310000000000002 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 72.439999999999998 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.529 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.439999999999998 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.439 ' HB3' HD22 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 75.239999999999995 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 74.5 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.529 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 9.7 tp-100 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.430000000000007 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.591 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 75.340000000000003 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.409999999999997 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 73.540000000000006 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.591 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.420000000000002 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 74.109999999999999 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 73.109999999999999 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.130000000000003 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.310000000000002 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 70.310000000000002 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 64.150000000000006 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.492 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.439999999999998 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.329999999999998 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 64.439999999999998 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.109999999999999 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 73.400000000000006 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 73.329999999999998 112.725 -175.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HB2' ' HE2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 74.230000000000004 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.472 HD22 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 74.519999999999996 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 72.430000000000007 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.409999999999997 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 75.099999999999994 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.109999999999999 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 73.120000000000005 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 63.200000000000003 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 75.019999999999996 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.219999999999999 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.310000000000002 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD22 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.219999999999999 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.400000000000006 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 73.230000000000004 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.418 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.340000000000003 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.129999999999995 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.549999999999997 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.319999999999993 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.140000000000001 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HZ1' ' HB2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 75.0 112.614 -174.484 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.310000000000002 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.519999999999996 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.489 ' O ' HG21 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.439999999999998 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 74.239999999999995 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 54.130000000000003 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.489 HG21 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 74.340000000000003 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 73.329999999999998 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.430000000000007 111.141 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.420000000000002 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 72.409999999999997 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.519999999999996 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 75.209999999999994 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 73.019999999999996 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 75.019999999999996 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.130000000000003 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.461 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 75.0 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 64.530000000000001 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.508 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 74.040000000000006 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 73.519999999999996 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.510000000000005 111.686 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 62.329999999999998 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 74.230000000000004 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 71.010000000000005 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.400000000000006 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 74.239999999999995 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.200000000000003 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.450000000000003 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.329999999999998 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.109999999999999 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.140000000000001 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.319999999999993 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 54.210000000000001 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.701 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 75.349999999999994 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 71.099999999999994 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.461 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 75.219999999999999 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.601 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 73.200000000000003 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.420000000000002 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 74.109999999999999 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.310000000000002 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.049999999999997 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 74.019999999999996 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 75.400000000000006 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 65.430000000000007 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.219999999999999 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 74.329999999999998 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.099999999999994 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.140000000000001 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.129999999999995 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.200000000000003 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.310000000000002 110.312 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.109999999999999 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.310000000000002 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 72.099999999999994 110.234 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 72.430000000000007 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.439999999999998 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.601 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.549999999999997 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.701 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 63.149999999999999 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 72.239999999999995 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.150000000000006 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.420000000000002 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 71.200000000000003 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 74.200000000000003 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.417 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.465 0.174 . . . . 72.109999999999999 111.138 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.18 29.06 67.08 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 119.51 -0.606 . . . . 72.140000000000001 114.07 174.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.0 t60 54.64 73.06 0.42 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.191 0.996 . . . . 75.319999999999993 109.98 -177.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.564 ' HE2' HD13 ' A' ' 17' ' ' LEU . 46.8 t60 -73.79 -40.1 63.65 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.182 -0.917 . . . . 74.129999999999995 110.25 -177.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 -84.3 96.35 8.99 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.911 -0.586 . . . . 75.319999999999993 109.995 175.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -86.25 154.49 21.24 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.844 0.858 . . . . 74.299999999999997 108.824 169.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.54 98.05 0.08 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.581 0.352 . . . . 73.439999999999998 111.151 176.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.9 t60 51.54 57.78 6.2 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.603 1.561 . . . . 73.420000000000002 111.779 170.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 t -72.32 89.43 1.22 Allowed 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.313 -0.858 . . . . 75.129999999999995 109.594 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -90.34 40.17 1.0 Allowed 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 122.54 1.162 . . . . 73.239999999999995 109.955 -178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.4 mtm -93.4 -35.71 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.941 -1.133 . . . . 72.120000000000005 107.941 168.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 49.8 82.11 0.25 Allowed Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 124.844 1.258 . . . . 65.109999999999999 110.614 -170.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.49 -23.58 70.87 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 122.617 2.211 . . . . 74.0 111.785 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 17' ' ' LEU . 24.7 t70 -170.06 104.68 0.31 Allowed 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.675 0.79 . . . . 71.530000000000001 108.913 -177.108 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.36 -24.36 66.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.938 0.495 . . . . 70.340000000000003 111.571 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.009999999999998 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.310000000000002 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.030000000000001 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.543 HG13 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 62.229999999999997 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 72.329999999999998 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 74.530000000000001 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.329999999999998 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.209999999999994 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.569 ' HA ' ' HH ' ' A' ' 39' ' ' TYR . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.420000000000002 112.136 178.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.463 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 65.030000000000001 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.200000000000003 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.409999999999997 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.530000000000001 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.540000000000006 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 61.43 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.581 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.430000000000007 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.319999999999993 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.420000000000002 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.581 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 74.420000000000002 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 71.340000000000003 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 74.439999999999998 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 75.329999999999998 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.25 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.569 ' HH ' ' HA ' ' A' ' 24' ' ' ASN . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.420000000000002 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.46 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.349999999999994 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.209999999999994 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 72.049999999999997 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 74.25 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.209999999999994 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.543 ' HG3' HG13 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 73.540000000000006 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 73.299999999999997 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 74.530000000000001 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.129999999999995 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.476 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 75.439999999999998 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.329999999999998 112.354 -177.576 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.476 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 72.329999999999998 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.439999999999998 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 71.430000000000007 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 74.230000000000004 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 74.519999999999996 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 74.030000000000001 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 70.519999999999996 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 72.519999999999996 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 62.100000000000001 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 73.019999999999996 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.59 ' HB3' ' HZ3' ' A' ' 62' ' ' LYS . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 74.420000000000002 111.021 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.209999999999994 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.420000000000002 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.099999999999994 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 71.329999999999998 111.655 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 72.409999999999997 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 63.109999999999999 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 73.409999999999997 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 75.239999999999995 109.782 170.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 74.329999999999998 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 70.409999999999997 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.465 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.439999999999998 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.140000000000001 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.319999999999993 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.606 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.120000000000005 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.129999999999995 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 72.129999999999995 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.299999999999997 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 75.549999999999997 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.420000000000002 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.530000000000001 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 73.430000000000007 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.63 HG21 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.409999999999997 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 75.299999999999997 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 70.420000000000002 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 75.0 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.489 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.409999999999997 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.150000000000006 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.465 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 75.129999999999995 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.445 ' HB1' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 62.219999999999999 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 64.230000000000004 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.219999999999999 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 74.129999999999995 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 74.200000000000003 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 72.310000000000002 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.510000000000005 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 71.239999999999995 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.468 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.219999999999999 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 74.019999999999996 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.230000000000004 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.450000000000003 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 74.409999999999997 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' MET . . . . . 0.511 ' HE1' ' NE2' ' A' ' 131' ' ' GLN . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 73.340000000000003 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.41 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.299999999999997 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.445 ' HB ' ' HB1' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 72.420000000000002 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.587 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.310000000000002 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 72.5 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 74.530000000000001 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . 0.506 ' HB2' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.319999999999993 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 73.230000000000004 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 75.329999999999998 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.549999999999997 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.129999999999995 109.964 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.240000000000002 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 62.240000000000002 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.63 ' SG ' HG21 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 53.200000000000003 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 64.209999999999994 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.109999999999999 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.489 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 73.349999999999994 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 60.240000000000002 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.239999999999995 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.340000000000003 110.427 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 75.219999999999999 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.120000000000005 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.587 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.219999999999999 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.299999999999997 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 71.230000000000004 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.310000000000002 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.511 ' NE2' ' HE1' ' A' ' 104' ' ' MET . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 74.120000000000005 110.838 172.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.409999999999997 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 74.430000000000007 110.24 176.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.599 -0.519 . . . . 75.409999999999997 109.599 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.65 -94.36 0.42 Allowed Glycine 0 C--N 1.342 0.912 0 O-C-N 123.489 0.493 . . . . 75.140000000000001 114.233 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.4 p-80 -84.72 129.99 34.75 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.34 0.591 . . . . 73.439999999999998 112.397 -168.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -149.45 132.19 15.96 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.227 1.811 . . . . 73.239999999999995 106.328 167.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -68.72 149.62 48.85 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 117.733 0.242 . . . . 61.140000000000001 110.509 -178.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -68.83 167.35 15.74 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.396 0.678 . . . . 75.439999999999998 111.353 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -59.89 156.18 14.93 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.412 0.685 . . . . 74.140000000000001 111.282 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -67.42 153.27 44.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.906 0.483 . . . . 72.439999999999998 111.231 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -60.72 134.38 57.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.988 1.315 . . . . 74.450000000000003 112.901 -165.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.425 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 53.3 m80 -142.11 152.83 43.63 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.605 1.162 . . . . 72.430000000000007 109.16 172.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.2 mtm -58.96 -58.88 6.7 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.488 1.115 . . . . 62.219999999999999 109.945 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -132.94 96.28 18.1 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.5 -1.296 . . . . 75.549999999999997 107.5 168.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.425 ' HG3' ' HB2' ' A' ' 10' ' ' HIS . 20.9 Cg_exo -64.03 -37.37 43.41 Favored 'Trans proline' 0 C--N 1.372 1.799 0 C-N-CA 122.286 1.991 . . . . 75.019999999999996 110.811 175.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -172.63 113.39 0.27 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.951 -1.022 . . . . 75.299999999999997 109.457 -175.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.406 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -60.99 -33.09 72.7 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.329 0.652 . . . . 73.150000000000006 110.356 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.487 ' HB2' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 64.140000000000001 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.510000000000005 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 71.239999999999995 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.409999999999997 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.530000000000001 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 74.239999999999995 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.443 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 71.319999999999993 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.219999999999999 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.515 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 74.340000000000003 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.430000000000007 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 70.409999999999997 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.477 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.310000000000002 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.230000000000004 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 74.209999999999994 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.030000000000001 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.519999999999996 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.450000000000003 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . 0.532 ' HB2' ' HZ1' ' A' ' 37' ' ' LYS . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 73.099999999999994 112.795 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 73.340000000000003 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.340000000000003 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.455 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.510000000000005 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.532 ' HZ1' ' HB2' ' A' ' 33' ' ' PRO . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 65.010000000000005 110.118 176.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 72.430000000000007 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.515 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.510000000000005 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 73.540000000000006 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.430000000000007 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 73.420000000000002 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 75.129999999999995 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.329999999999998 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.010000000000005 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.487 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.340000000000003 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.404 ' O ' HD11 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.530000000000001 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.239999999999995 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.441 ' HB3' HD21 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.420000000000002 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.464 ' HB2' ' HB3' ' A' ' 76' ' ' CYS . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 64.120000000000005 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 74.430000000000007 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.56 HD13 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.109999999999999 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.47 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.219999999999999 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.329999999999998 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.109999999999999 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.455 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 75.129999999999995 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 64.319999999999993 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 74.049999999999997 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.120000000000005 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 74.209999999999994 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.477 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.099999999999994 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.129999999999995 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 73.019999999999996 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.420000000000002 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.484 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.010000000000005 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 72.129999999999995 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 74.450000000000003 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.430000000000007 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.507 HD12 ' HE2' ' A' ' 97' ' ' MET . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.519999999999996 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.459 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.130000000000003 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.219999999999999 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 74.450000000000003 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 73.040000000000006 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.47 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.540000000000006 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.455 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.349999999999994 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 72.200000000000003 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.404 HD11 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.510000000000005 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.455 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.340000000000003 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.455 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.129999999999995 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.430000000000007 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 74.420000000000002 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.526 HD12 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.219999999999999 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.230000000000004 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.540000000000006 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 72.239999999999995 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.349999999999994 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.519999999999996 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.413 ' HB3' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 73.310000000000002 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 61.200000000000003 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.540000000000006 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.329999999999998 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.129999999999995 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.507 ' HE2' HD12 ' A' ' 70' ' ' LEU . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 72.430000000000007 110.107 177.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 71.219999999999999 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.099999999999994 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.349999999999994 112.339 177.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 75.219999999999999 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.44 ' O ' HG22 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 74.319999999999993 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 74.420000000000002 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.319999999999993 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 64.120000000000005 109.69 173.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.200000000000003 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . 0.61 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.299999999999997 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 75.140000000000001 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LYS . . . . . 0.514 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 75.420000000000002 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 63.32 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.566 HD23 ' HB3' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.019999999999996 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.019999999999996 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 73.519999999999996 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.129999999999995 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.497 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 64.439999999999998 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 64.310000000000002 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.739 ' SG ' ' HB1' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 74.049999999999997 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.129999999999995 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 75.340000000000003 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.739 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.219999999999999 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ALA . . . . . 0.566 ' HB3' HD23 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 73.109999999999999 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.239999999999995 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 71.319999999999993 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.230000000000004 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.340000000000003 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.61 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.430000000000007 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 72.209999999999994 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 73.409999999999997 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 65.540000000000006 111.563 175.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 71.519999999999996 109.111 -173.765 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 111.048 0.018 . . . . 75.42 111.048 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.45 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 41.42 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.52 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.562 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.23 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HB2' HD21 ' A' ' 52' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.22 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 55.23 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 53.53 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.412 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 73.41 112.279 167.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 64.51 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.12 109.708 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.51 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 63.42 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.24 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 71.24 110.333 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 64.13 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.42 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.548 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.31 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.548 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.42 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.35 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.32 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 55.14 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 72.0 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.412 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 31.4 m80 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.44 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.33 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.43 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.31 110.148 175.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.13 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 64.32 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 64.22 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 71.14 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 52.54 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.04 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 73.42 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.757 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 34.55 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 63.25 111.716 176.782 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 64.53 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 74.51 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.44 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 72.45 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 65.42 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.42 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 65.4 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 71.52 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.1 112.975 -177.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 71.21 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 62.33 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 71.24 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 63.01 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.43 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 73.33 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.13 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 60.55 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.15 111.546 177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 64.53 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 61.4 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.44 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.04 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 70.31 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.31 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.757 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.43 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.41 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 55.44 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.44 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 50' ' ' ALA . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.34 107.818 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 61.24 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 71.53 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.23 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.31 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 63.22 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 61.44 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.31 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.42 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.01 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.22 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.02 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.14 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 54.25 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.52 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 51.21 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 51.02 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 62.42 109.901 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 50.43 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.432 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 70.25 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.25 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 70.41 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 73.21 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.23 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.31 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.4 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.512 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.596 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 71.22 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.54 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 112' ' ' ASP . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.41 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 72.12 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.2 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.52 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.33 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.21 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 70.43 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.55 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.33 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.15 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.45 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 72.41 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 32.01 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.21 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.04 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.54 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 60.11 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 61.25 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.596 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.43 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 53.44 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.1 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 63.22 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.01 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 70.0 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 52.11 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 120.537 0.208 . . . . 74.15 110.938 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.13 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.42 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 72.21 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.14 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.14 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.45 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 60.14 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 64.44 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.05 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.11 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.43 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.24 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 70.4 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 71.52 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 71.02 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.469 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 64.13 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.31 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 6.5 tp60 -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 63.21 111.508 -176.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 42.1 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 73.22 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.24 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.11 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 71.05 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.11 110.928 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.1 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 62.43 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.33 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 53.14 111.675 -178.084 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.05 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.03 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.538 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.12 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.538 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 63.42 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.793 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.03 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 63.41 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 44.12 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.02 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 63.15 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.22 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.24 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.52 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 52.11 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 53.15 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 53.11 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 53.22 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 61.34 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 73.01 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 72.22 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.23 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 65.41 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.43 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.55 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.34 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 62.24 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 72.15 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.32 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.465 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.03 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.04 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 50.11 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.599 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.43 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.14 111.19 177.333 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 54.11 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.15 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.793 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.15 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.52 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.05 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.04 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 65.14 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 55.13 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.14 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 64.52 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.31 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.12 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.479 ' NZ ' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 71.22 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 73.32 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.51 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.43 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 54.12 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.24 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.3 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 73.2 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 65.54 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.23 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.31 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.12 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.418 ' O ' HG23 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 52.45 110.557 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 63.12 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.406 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.33 112.007 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.14 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.595 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 61.34 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.875 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.02 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.54 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 41.13 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.14 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 71.1 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.42 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.11 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.31 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 61.43 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.42 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.3 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 54.32 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.35 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.554 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 61.4 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.45 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 54.0 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.465 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 71.22 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.12 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.45 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.875 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.24 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 61.54 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.43 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.44 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 60.44 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.55 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 71.43 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 62.32 109.947 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 73.04 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.559 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 42.23 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.24 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 72.51 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HB2' HD11 ' A' ' 52' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 51.22 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.02 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 73.42 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.21 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.425 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 54.31 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 62.31 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 61.44 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 55.3 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 1.6 pp0? -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.24 111.555 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.33 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.54 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 73.31 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.525 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 70.42 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.408 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.01 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.43 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 53.2 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 72.52 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.25 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.425 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 64.04 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.43 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.45 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.05 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.33 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 71.42 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 51.42 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 72.45 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 54.53 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.49 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.11 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.31 111.268 175.546 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.596 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.24 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.22 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 64.14 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.41 109.805 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.34 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.4 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.34 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.12 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.44 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 61.45 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 70.43 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.33 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 71.34 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 70.53 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.424 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 64.54 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.23 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 62.1 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 64.4 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.439 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.44 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 72.2 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.41 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 71.01 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.1 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.495 ' SG ' HD12 ' A' ' 79' ' ' LEU . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.21 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 73.32 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 71.33 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.495 HD12 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.04 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.51 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 62.41 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 73.25 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.33 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.21 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 72.31 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.417 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.33 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 64.02 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.04 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.13 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 72.32 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.558 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.31 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.14 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.24 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.32 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 64.31 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 55.53 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 62.54 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.15 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.33 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.22 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.12 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 106' ' ' VAL . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.22 109.649 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.2 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.488 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 64.45 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.15 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.22 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.42 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 64.3 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 64.23 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.808 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.13 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.23 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 71.54 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.32 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.33 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 62.52 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 51.04 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.808 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 64.54 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.23 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.33 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.45 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 73.21 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.1 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 52.05 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 72.44 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.51 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 72.45 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.33 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.14 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.43 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.42 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.35 111.677 176.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 63.43 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 64.44 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.15 110.072 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 61.25 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.23 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 62.02 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.517 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.24 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.4 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.21 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.33 110.291 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.31 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 64.01 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.31 112.511 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.14 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 53.12 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.55 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 73.53 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.618 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 44.21 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.03 113.019 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 53.14 111.523 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 7.8 tp60 -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.52 111.308 -177.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 63.14 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 73.52 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.35 110.478 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.13 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.45 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 73.31 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.23 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.23 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 71.1 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.33 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.517 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.21 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.33 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.15 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 63.42 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 70.02 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.22 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.51 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.41 109.927 173.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.13 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 70.34 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 71.4 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 75' ' ' GLU . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 60.13 109.979 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.01 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 72.03 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.3 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 65.33 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 73.14 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.13 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.35 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 62.3 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.54 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 72.33 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.44 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 53.2 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 52.03 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.15 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 72.24 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.42 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.44 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.41 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 56' ' ' ARG . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.21 111.169 178.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 64.04 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 72.11 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 63.31 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.24 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.32 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.24 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.417 HG22 HD22 ' A' ' 113' ' ' LEU . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 45.43 112.702 -172.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.41 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.34 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.33 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 42.21 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 65.3 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 51.33 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 73.24 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.53 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.05 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.44 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 54.44 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.12 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 64.44 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 72.32 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 53.11 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 65.2 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 72.21 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 72.1 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 64.45 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 61.44 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 50.13 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.41 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 73.15 111.695 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.02 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.555 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 63.0 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.635 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.41 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 63.34 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 70.15 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.545 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 54.03 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.12 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 50.23 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 64.4 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.544 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 62.11 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.2 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.43 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.545 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.31 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 73.44 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.21 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 50.31 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 44.3 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.03 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 10.32 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.35 110.215 175.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 72.12 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.42 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.635 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.4 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.42 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 74.41 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.23 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 63.44 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 60.22 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.14 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.646 0.239 . . . . 73.13 111.646 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.1 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.21 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 74.43 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.22 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.02 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.14 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.41 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 44.32 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.41 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.04 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.23 109.964 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 55.44 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.14 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 53.3 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.54 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 64.35 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.55 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 70.04 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.15 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.53 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 71.43 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 64.11 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 70.15 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 65.04 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 61.02 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.44 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.22 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 54.51 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 53.33 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.44 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.22 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 42.33 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HA ' HD22 ' A' ' 79' ' ' LEU . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 73.11 111.936 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.44 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.1 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 74.41 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 70.14 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.11 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.01 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.11 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 52.11 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 74.32 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.12 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.55 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.53 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 70.34 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 73.02 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 51.13 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.3 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.32 111.942 -176.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.22 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.54 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.23 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 54.53 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 63.41 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 62.54 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 71.31 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.02 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.31 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 73.13 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 64.54 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 53.0 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 73.21 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 48' ' ' LYS . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 72.33 110.456 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.24 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 55.43 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.469 ' HA ' HD22 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.24 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 61.55 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.637 HG23 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.23 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.11 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.475 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 62.34 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.415 ' HD1' HG13 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 72.01 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 64.23 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 74.01 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.12 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 61.02 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 63.13 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.04 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 65.1 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.439 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.35 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.02 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 64.44 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.33 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 63.22 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.439 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 65.13 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.1 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 72.05 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.527 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 52.55 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.34 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 71.34 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.415 HG13 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.54 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 71.21 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.51 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.43 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.842 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 54.45 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.33 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 63.44 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.469 HD22 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.43 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.23 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.12 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 53.11 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.842 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.31 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 72.33 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 54.44 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.567 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 65.11 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 53.31 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 63.01 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.34 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 128' ' ' MET . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.45 111.481 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 74.42 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 73.51 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 61.0 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 124' ' ' TYR . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.14 111.206 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 63.24 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 42.12 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.44 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.22 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.13 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.345 0.117 . . . . 64.53 111.274 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.23 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 71.32 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 60.5 110.949 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.615 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 73.41 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 72.52 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.53 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.671 ' HE2' ' CD2' ' A' ' 38' ' ' HIS . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.43 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 60.23 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.22 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 64.23 112.008 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.35 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.1 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.14 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 70.52 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.35 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.42 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 61.14 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 52.51 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.521 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 64.42 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 72.02 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.671 ' CD2' ' HE2' ' A' ' 22' ' ' LYS . 44.7 m80 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.41 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.31 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 63.32 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.442 ' OE2' ' HD2' ' A' ' 38' ' ' HIS . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.34 110.963 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 62.52 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 72.33 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 72.13 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HG3' HG11 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.23 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.13 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.32 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.42 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.42 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.495 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.32 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 74.5 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.11 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.23 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 63.34 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.43 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 63.22 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 64.11 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.33 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.41 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.54 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.33 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 51.12 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.44 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 71.54 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.43 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 71.52 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.44 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.52 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 53.51 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 71.45 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.53 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.33 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.656 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.23 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.43 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.53 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 72' ' ' ASP . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.03 110.174 172.578 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.02 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 74.33 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 72.0 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.33 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.32 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.15 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.1 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.412 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 44.22 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 54.21 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 70.22 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.573 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.13 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.656 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.43 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 62.44 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 51.54 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 54.51 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 63.12 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.24 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 52.54 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 41.44 110.274 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.52 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.21 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.24 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.34 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 62.13 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 53.1 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 74.41 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.45 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.33 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.24 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.11 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.705 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 22.14 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.32 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.3 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 72.22 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.473 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.22 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.41 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 61.51 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.705 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 35.31 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 62.32 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.12 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 33.44 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 64.22 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.43 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 34.42 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 70.35 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.3 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.41 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.13 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.22 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.34 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.11 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 70.44 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.13 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.3 110.749 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.43 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 62.43 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 70.13 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.461 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 62.15 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.01 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 72.13 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 62.12 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 61.13 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.21 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.01 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.01 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 51.53 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 62.54 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 73.53 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 52.31 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.43 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.54 113.12 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 72.42 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 52.34 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.14 109.833 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.04 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.21 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.42 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 70.43 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.02 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.11 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 73.11 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG3' HG11 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 72.4 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.31 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 64.42 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.42 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB3' HD23 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 62.04 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 72.22 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 71.34 111.279 177.087 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 73.34 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 63.1 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 43.42 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 53.21 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.14 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 42.34 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.21 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 62.23 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 62.33 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.41 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.13 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.52 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD13 ' HE1' ' A' ' 66' ' ' PHE . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.1 112.851 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.45 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.405 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 71.52 111.1 177.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.13 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 63.3 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 72.43 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 72.25 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 63.11 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.14 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 63.32 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 71.34 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 35.41 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.434 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.23 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.54 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.03 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.21 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 63.43 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.24 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.42 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.45 HG23 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 73.21 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.463 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.33 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 54.1 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.33 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.23 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.11 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 62.44 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 54.42 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 54.44 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 52.33 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.42 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.2 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 72.31 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.51 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 63.22 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.41 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 61.14 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 106' ' ' VAL . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 62.02 111.3 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.4 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.4 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 52.44 112.061 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 60.42 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.482 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 70.23 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.21 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 70.55 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.665 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.22 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.11 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 64.21 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 62.35 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.34 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.31 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.22 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.665 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.33 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 61.05 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.23 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.04 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 63.13 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.11 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 32.0 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.4 111.173 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.42 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.31 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.13 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 54.23 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 60.13 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 62.35 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.04 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.11 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 121.121 0.486 . . . . 65.32 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 70.15 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.44 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.12 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.609 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.13 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.52 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.23 111.276 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.14 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.23 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.42 111.118 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.05 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.51 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.52 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.23 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.23 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 63.31 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.714 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.31 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.01 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 73.32 111.835 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.714 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 73.55 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 62.24 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 72.02 109.644 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.2 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 71.54 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 70.0 110.615 167.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.13 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 62.44 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.631 HD12 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 62.24 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 52.01 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 51.4 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 73.53 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.42 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.44 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.52 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.21 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.21 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.22 111.707 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 73.12 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.41 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.02 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.1 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.631 HH21 HD12 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.14 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.43 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HD2' ' A' ' 89' ' ' ARG . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.34 110.93 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.14 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.51 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 71.23 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.51 110.282 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 53.52 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.21 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.42 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.54 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 73.31 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.34 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 43.12 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 73.55 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 53.45 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.43 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.414 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.53 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 64.34 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.15 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.642 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 70.12 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.696 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 60.44 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.34 110.676 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 71.25 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.1 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.696 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.21 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.11 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.24 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 55.33 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.14 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.53 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 60.04 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.2 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.402 ' HD2' ' HB1' ' A' ' 58' ' ' ALA . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 63.31 111.101 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.03 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.55 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.24 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 54.24 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 71.54 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.1 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 63.1 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.32 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 73.53 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.31 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.33 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.32 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 64.4 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 33.54 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.475 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 63.44 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.42 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 102' ' ' LYS . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 44.54 109.604 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.475 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 73.05 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.51 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.565 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.53 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.564 ' HB1' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.52 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.711 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.41 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.21 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 62.44 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 73.33 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.33 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.52 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.711 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 62.32 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 73.02 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.32 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 62.2 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 65.34 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 72.52 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 61.14 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.31 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.21 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 74.31 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 64.22 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 72.13 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.14 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.32 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 71.51 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 61.23 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.77 0.319 . . . . 62.43 110.837 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 55.11 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 62.14 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.32 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.528 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 72.15 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 71.42 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.411 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 55.21 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 53.5 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 34.34 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 64.15 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.32 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 51.2 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.52 110.253 173.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 64.34 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.32 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 53.43 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 70.52 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.624 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.34 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 61.13 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.22 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 63.32 110.795 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.33 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 64.51 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.4 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.416 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.41 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.14 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.45 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.507 HG13 HD12 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 65.43 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.41 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.41 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.418 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 63.14 111.922 -178.185 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.22 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HA ' HD13 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 70.15 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 44.11 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.1 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 63.14 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 44.12 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.22 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.52 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 63.21 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.15 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 63.42 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 71.34 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.21 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.22 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 53.21 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 71.4 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 72.5 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.407 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 63.21 112.376 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.02 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 65.22 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 71.33 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.31 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 70.34 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 72.34 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.23 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.23 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.668 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 70.11 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 64.11 111.897 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 63.42 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.668 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.35 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.15 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.22 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 73.21 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 51.35 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.411 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 63.13 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 65.23 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.433 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 74.3 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.21 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.11 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.433 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 41.3 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 73.45 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.52 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.2 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.47 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.14 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 63.41 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.43 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.481 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.33 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 53.01 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.32 111.135 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.24 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.3 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 63.01 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 64.4 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.11 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.31 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 63.34 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.24 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 102' ' ' LYS . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.55 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 54.33 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 74.34 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 63.0 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.717 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.15 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.44 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 60.32 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.21 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 64.25 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 54.13 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.717 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.12 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.13 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.33 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.477 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 53.24 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 64.54 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 65.31 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.23 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.23 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.53 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 54.41 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.683 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.41 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 72.4 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.53 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 71.43 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.01 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.21 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.45 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.145 0.498 . . . . 72.04 110.756 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.1 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.55 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.44 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.576 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 64.35 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.53 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.583 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 72.34 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.45 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.43 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.583 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.34 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.44 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.42 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 72.22 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 63.33 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 65.2 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.31 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.476 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 71.1 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.51 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.41 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.542 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.33 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.43 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 63.23 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.03 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 71.24 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.3 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 52.32 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.2 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 61.25 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 50.22 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.33 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 52.21 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 72.14 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 60.44 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 45.41 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.42 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 55.14 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 62.32 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.404 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.43 114.494 -171.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 73.32 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 71.51 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 63.42 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.45 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 71.51 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 61.25 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.41 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.34 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.21 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.415 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 73.42 111.213 -177.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.31 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 64' ' ' LEU . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.04 112.741 -174.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.11 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.22 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 41.42 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 55.1 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.21 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.22 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.597 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.23 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 72.3 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.44 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.678 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 65.44 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.42 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.51 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 73.4 109.911 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.35 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.24 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.3 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 71.24 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.54 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.01 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 52.41 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 63.32 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.24 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 70.34 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.597 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.12 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.593 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.1 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 55.25 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 53.13 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 71.11 111.403 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.34 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.21 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.43 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.34 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.52 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.478 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.45 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 63.53 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.34 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.576 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.1 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.12 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.53 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 63.31 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.34 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.13 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.54 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.32 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.24 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.44 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 65.01 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 63.42 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 62.43 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 63.52 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 72.44 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 33.34 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.03 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.12 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 64.15 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.21 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.52 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 63.44 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 73.05 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 54.31 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 63.33 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 71.54 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 63.15 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.51 109.551 -173.216 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 111.5 0.185 . . . . 72.55 111.5 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.44 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 62.32 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 64.0 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.11 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.44 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.21 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 71.12 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 63.24 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.451 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.0 m-20 -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 64.41 111.111 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 73.15 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.13 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.32 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.01 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 65.31 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.43 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 63.32 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.41 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.34 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 64.12 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.21 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.728 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.24 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.15 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.31 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.34 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.34 109.879 -179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.43 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.21 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.41 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 40' ' ' THR . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 62.44 111.492 177.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 73.32 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.42 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 61.42 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.14 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.31 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.43 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 71.22 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 49' ' ' ASP . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 64.02 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 72.24 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.22 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.54 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.728 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.44 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.14 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.54 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 72.14 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.51 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 71.34 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 65.11 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 73.14 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 74.31 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 54.12 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 54.41 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 53.54 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.41 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 70.25 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 65.54 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.44 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.12 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.575 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 64.24 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.54 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.14 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.23 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.477 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 71.14 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.21 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.14 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 70.43 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.477 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 53.11 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 70.14 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.4 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 85' ' ' LYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 54.15 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.54 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.43 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 74.42 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 21.5 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.12 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.575 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.22 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.2 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 53.53 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.413 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 62.31 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.03 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.21 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 52.44 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.22 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 73.15 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.21 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 63.32 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.13 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.11 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.558 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.34 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.481 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 61.23 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.05 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.543 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 71.33 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.3 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 73.23 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.54 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.575 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 54.45 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 71.14 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.453 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.21 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.42 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.54 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 70.03 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 44.02 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.575 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.3 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 72.52 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 53.4 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.33 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 65.14 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 71.2 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 60.13 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.481 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.21 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 63.45 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 71.11 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 64.41 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 61.44 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.13 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 42.25 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.42 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 71.12 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.21 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 60.14 110.386 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 19' ' ' VAL . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 61.41 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.44 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 50.21 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.612 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.33 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 61.31 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.53 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.493 ' H ' ' HD2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 61.41 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 60.31 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.21 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.34 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 53.25 111.655 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.44 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.04 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.01 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.34 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.31 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.416 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.24 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.14 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 64.5 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.05 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 64.44 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 72.22 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.43 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.21 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 62.03 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 72.41 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 53.13 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.04 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.21 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.612 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.12 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.565 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 53.22 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.21 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HA ' HD22 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 71.13 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.42 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.51 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 61.05 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 46' ' ' ASN . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.15 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.658 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.21 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.3 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 71.45 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 73.34 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.14 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 54.41 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.24 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.24 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.42 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 73.25 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 72.13 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.23 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.41 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.32 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.53 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.04 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.34 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.04 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.12 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.442 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.02 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.21 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.21 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.13 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 72.04 110.392 178.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.44 111.156 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.23 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 65.12 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.12 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.23 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.479 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.23 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 52.22 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.44 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLY . . . . . 0.479 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 63.54 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.424 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.12 111.304 173.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.617 HG23 ' HB2' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 71.1 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.51 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.442 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.1 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 52.32 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.32 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 60.44 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.32 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 73.02 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.43 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 72.2 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.42 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.03 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 72.1 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 43.15 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.21 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 43.42 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.04 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.42 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 72.42 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.457 ' HD1' ' HB1' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 74.23 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 71.42 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 72.45 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.706 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.41 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.34 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.52 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.43 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.02 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.14 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.33 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.706 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 60.21 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 73.35 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.12 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.617 ' HB2' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.22 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 73.51 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.13 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.42 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.43 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 73.2 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 65.32 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 72.2 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.23 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 53.24 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.44 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.35 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.52 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.21 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.44 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 121.084 0.468 . . . . 74.11 109.92 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.42 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 55.34 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.53 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.548 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 62.24 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.53 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 63.45 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 63.21 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.22 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 55.44 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.13 111.487 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.3 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.23 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 55.22 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 61.24 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 71.34 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 72.25 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.13 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.544 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 8.2 tp60 -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.2 111.36 179.16 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 63.31 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.42 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 72.15 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.474 ' HD2' ' OE1' ' A' ' 41' ' ' GLU . 34.7 m170 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.34 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.34 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.1 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.474 ' OE1' ' HD2' ' A' ' 38' ' ' HIS . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.05 110.259 173.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 73.21 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.33 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 51.22 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.33 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 73.21 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 35.24 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.25 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 52.51 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 62.42 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.547 ' HD3' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.32 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 71.33 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HA ' ' HG2' ' A' ' 56' ' ' ARG . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.35 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 62.12 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 53' ' ' TYR . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 65.02 110.139 178.024 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 51.14 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.31 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 73.14 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.22 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.34 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 53.42 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.53 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.24 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.52 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 63.32 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.32 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.34 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 74.4 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.61 HD11 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 72.2 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.51 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 71.3 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.51 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 63.4 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.54 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 72.32 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.15 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.41 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 62.35 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.479 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.41 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 64.2 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.34 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.7 HG23 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 64.3 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 64.21 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.43 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.41 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 73.52 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.05 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 50.2 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.31 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.05 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 64.14 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 63.04 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.4 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.31 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG3' HD11 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 60.21 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.33 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.35 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.449 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.04 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.518 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.4 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 63.1 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 44.14 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.518 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 61.23 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.1 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 102' ' ' LYS . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 73.44 110.807 -171.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.02 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.34 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 71.04 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.773 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 44.54 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.14 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.14 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.12 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.15 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 64.43 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.51 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.773 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.32 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.55 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.44 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.41 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 44.21 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.23 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.53 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.43 110.737 173.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.44 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.1 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 74.34 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 72.4 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.23 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.22 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 65.05 111.757 174.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 71.14 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.22 109.075 175.456 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 120.653 0.264 . . . . 70.42 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.05 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.689 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.24 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.54 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.577 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.11 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.43 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.51 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.419 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 63.01 110.395 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 61.44 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.34 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.42 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.419 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.03 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 51.51 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 73.23 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 73.43 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 34.22 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.53 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.53 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.23 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.44 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.54 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.12 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.31 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.3 109.205 173.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 73.42 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 73.2 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.54 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.13 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 71.11 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 71.45 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.577 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 61.33 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 70.34 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.12 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.02 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.574 ' HB3' HD23 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.54 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.648 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.54 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 51.03 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 64.54 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.42 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.11 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.13 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 63.14 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 62.32 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 63.41 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.11 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 52.11 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.51 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.54 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 73.22 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.402 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 41.34 112.096 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 72.12 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 72.11 112.446 -177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 71.34 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 65.14 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 45.25 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 63.24 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 72.41 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 64.21 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HG ' ' HZ ' ' A' ' 83' ' ' PHE . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.03 111.206 173.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 71.23 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.22 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.21 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 71.14 110.312 173.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.44 109.71 -177.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.03 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.33 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 40.44 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 64.2 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 73' ' ' CYS . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.15 110.087 -177.038 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.3 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.446 ' HD2' ' N ' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.3 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.22 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.3 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.478 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 63.24 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.15 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 71.23 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.3 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 23.22 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 64.44 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.34 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.22 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 53.42 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.15 110.414 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 71.11 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.11 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 65.55 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.12 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 34.14 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 65.54 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.24 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 61.31 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 64.33 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 61.23 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.24 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.44 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.795 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.32 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.34 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 71.32 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.31 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.13 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 64.01 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.795 ' SG ' HD23 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.03 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.31 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.478 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.41 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.02 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.1 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.14 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 64.21 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 72.55 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.43 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 62.25 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.32 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 73.33 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.21 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.43 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 61.34 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.02 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 121.418 0.628 . . . . 74.14 110.207 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.62 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 72.21 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 72.44 110.578 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.482 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 71.42 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 65.15 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 61.21 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 64.11 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.32 114.04 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 44.12 112.282 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.41 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 72.14 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.5 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.04 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.23 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 72.12 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.3 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.44 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 71.54 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 60.25 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.652 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 18.9 mm100 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.21 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.14 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.1 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 74.43 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 71.14 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.51 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.14 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.11 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 72.11 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 71.31 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 60.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.43 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.44 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.04 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.21 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.04 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 64.02 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 65.45 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.13 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.01 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 70.13 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 71.15 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 61.34 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 62.45 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.4 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.53 111.841 -174.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.11 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 62.43 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.33 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 70.44 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 71.24 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.4 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.22 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.33 111.887 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 63.54 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.53 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.14 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.42 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 77' ' ' ILE . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.34 111.248 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.03 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.41 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 61.32 110.49 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.24 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 54.03 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 70.04 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 63.1 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.23 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.04 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.6 HG23 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.55 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.42 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 60.23 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.1 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 72.03 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.482 HH21 HG22 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.42 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 72.2 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.12 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.12 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.04 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.43 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.14 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.23 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.34 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.34 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 73.32 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 61.1 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 70.53 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 52.45 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.455 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 64.3 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.518 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 71.21 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.631 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.45 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.43 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.558 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.52 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.631 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.44 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.24 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.44 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 65.22 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.04 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 70.25 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.23 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.631 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 72.23 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 73.41 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.34 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 61.54 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.23 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.2 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 53.54 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.23 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.41 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 72.54 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.631 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.15 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 71.32 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 70.1 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 51.52 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.42 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.22 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.547 0.862 0 CA-C-O 121.311 0.577 . . . . 75.55 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.14 112.945 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.54 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 62.45 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 61.31 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.43 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 73.02 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.32 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 64.32 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.22 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.03 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.44 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.02 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 74.35 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.14 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.671 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.31 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.14 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 65.11 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.3 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.31 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 64.45 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 70.55 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.625 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.34 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 63.3 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 72.32 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 62.42 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 34.34 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 64.52 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 61.33 110.505 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 10.1 p30 -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.31 110.961 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 72.21 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.53 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.34 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.11 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.23 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 64.14 111.055 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.24 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.15 112.777 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 44.44 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 71.24 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.04 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 64.11 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 62.24 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.14 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.14 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.22 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.53 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.431 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.21 111.808 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.04 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 62.34 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.24 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 73.35 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 65.53 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.51 HD11 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.01 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 64.22 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.42 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 65.44 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.4 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 64.4 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.2 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.22 110.251 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 74' ' ' GLU . 14.0 mm100 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.15 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.43 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 73.34 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.33 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 71.31 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.45 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 72.24 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.32 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 54.23 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.32 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 64.15 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 73.52 110.03 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.24 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.42 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 62.4 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.44 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 102' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.33 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 65.11 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 53.23 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.51 ' HG3' HD11 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 62.13 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.33 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 71.22 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.53 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.44 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.503 ' HB2' HD13 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 64.32 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.2 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.24 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 61.54 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 102' ' ' LYS . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.14 109.397 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.0 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.51 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.35 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 74.14 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 71.33 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.1 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.32 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.42 ' HB3' HD13 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.33 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 51.05 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.22 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.33 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.24 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 63.01 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 53.44 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 64.53 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.31 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.33 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.41 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.417 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 71.13 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 73.15 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 63.41 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 71.15 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.13 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.32 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.14 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.42 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 121.157 0.503 . . . . 72.23 110.735 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 70.31 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 62.53 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.01 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.6 HG11 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.13 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 72.21 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 70.54 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 72.14 110.448 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 71.15 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 51.32 110.105 174.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.45 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.42 112.602 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.33 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 61.24 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 63.15 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.53 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.455 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.33 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.467 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.33 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . 0.503 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.03 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 72.32 111.188 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.455 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 71.34 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.512 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 61.14 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.21 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.3 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.15 111.251 167.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.44 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.32 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.31 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 71.42 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.25 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.6 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.13 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.6 p30 -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.05 111.081 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 53.43 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 51.44 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.51 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.408 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 65.01 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 71.43 110.143 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.03 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 61.33 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 72.13 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.11 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.512 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 71.41 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 50.23 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.23 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.24 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 71.14 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.11 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 55.01 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.429 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 63.12 111.575 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.21 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.43 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 61.51 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.33 108.964 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 70.21 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.33 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 54.41 112.092 -174.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 71.14 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.415 ' SG ' ' HD2' ' A' ' 90' ' ' LYS . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.02 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 72.31 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.11 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.408 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.11 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 72.51 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.32 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 73.02 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.32 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.43 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 53.51 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.54 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.449 HD13 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.23 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 60.13 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.22 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.23 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 64.22 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.404 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.23 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.415 ' HD2' ' SG ' ' A' ' 73' ' ' CYS . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 74.44 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 72.14 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.22 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.34 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 73.31 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.31 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.54 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.45 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.33 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 51.43 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.43 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.3 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.04 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 61.04 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 64.2 111.975 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.24 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 53.33 110.802 -169.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 74.3 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 53.24 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 63.52 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.34 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.667 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 62.22 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 71.04 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.24 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.449 ' HB2' HD13 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 64.23 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 65.01 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.34 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.667 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.43 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.44 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 72.13 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.12 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.53 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 60.4 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.13 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.15 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.23 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 63.32 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 34.14 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.14 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 73.51 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 32.31 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.23 111.224 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 72.43 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.42 108.681 174.615 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 111.88 0.326 . . . . 65.45 111.88 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.655 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.42 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 71.15 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.2 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 63.52 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.23 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.34 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.12 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.45 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.32 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.51 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.31 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.23 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 72.33 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 63.4 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.21 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' HD21 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 72.03 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 54.13 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 66.6 tp60 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.31 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.604 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 53.44 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.41 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 54.11 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.604 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.42 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 72.34 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 71.2 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.13 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.31 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 53.52 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 45.23 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.44 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.32 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 52.22 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.11 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 71.43 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB2' ' HB2' ' A' ' 79' ' ' LEU . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 63.21 112.725 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 70.4 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 72.24 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 55.14 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.41 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 65.03 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.11 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 72.14 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 60.42 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 73.12 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.22 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.31 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.22 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.4 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 64.42 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.34 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.13 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.55 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.32 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.14 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 62.14 112.614 -174.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.31 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.52 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.532 ' O ' HG22 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.44 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 61.11 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 53.41 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 73.33 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 72.03 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.43 111.141 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.42 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 45.34 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.52 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 72.5 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 71.54 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 74.32 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.13 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.511 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 65.14 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 54.35 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.534 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 72.45 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 64.32 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.425 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.51 111.686 -176.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 61.34 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 53.22 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 55.33 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.4 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 72.41 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.15 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.24 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.33 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.11 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.14 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.32 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 43.25 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.711 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 52.51 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 65.02 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.511 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 74.12 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.623 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 63.22 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.42 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 63.25 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.31 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.05 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 62.41 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 71.1 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 63.42 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.22 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 50.2 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.1 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.14 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.13 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.2 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.31 110.312 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.11 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.31 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 64.24 110.234 175.122 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 61.32 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.11 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.623 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.55 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.711 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 50.54 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 55.45 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.15 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.23 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 52.52 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 43.03 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 111.571 0.211 . . . . 63.42 111.571 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.01 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.618 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.2 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.03 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.565 HG11 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 50.42 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 60.03 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 72.4 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.33 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.21 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.01 112.136 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 64.52 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.2 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.41 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.53 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.54 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 55.34 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.43 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.32 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.42 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.599 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 71.43 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 70.43 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 73.11 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 74.43 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.15 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.412 ' O ' HG13 ' A' ' 43' ' ' ILE . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.42 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.35 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.21 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 54.22 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 72.35 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.21 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HG3' HG11 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 60.45 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 62.22 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 24.32 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.13 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.491 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 73.33 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.33 112.354 -177.576 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.491 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 63.4 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.44 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 62.11 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 63.25 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 63.12 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 61.24 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 61.14 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 71.41 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 61.1 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 72.43 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 70.31 111.021 -174.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.21 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.33 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.1 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.404 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 70.45 111.655 -179.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 44.2 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 62.25 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 44.1 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 74.42 109.782 170.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 73.45 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 60.03 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.477 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.44 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.14 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.32 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.588 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.12 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.13 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 55.33 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.3 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 73.12 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.21 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.32 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 64.0 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.641 HG23 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.41 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.421 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 63.42 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 42.14 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 74.52 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.41 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.15 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 72.2 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 55.32 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 63.42 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.22 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 53.3 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 62.22 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 61.41 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.51 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 55.3 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.22 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 71.54 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.23 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.45 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 64.3 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' MET . . . . . 0.511 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 51.54 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.3 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 65.44 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.636 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.31 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 65.44 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 70.54 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . 0.561 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.1 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 64.12 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 72.23 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.55 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.417 ' HB3' HD11 ' A' ' 84' ' ' ILE . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.13 109.964 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.24 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 51.22 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.641 ' SG ' HG23 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 52.32 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 62.04 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.11 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.514 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 63.13 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 43.22 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.24 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 104' ' ' MET . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.34 110.427 176.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 51.54 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.12 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.636 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.22 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.3 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 33.25 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.31 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 63.55 110.838 172.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.41 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 72.41 110.24 176.043 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 121.063 0.459 . . . . 70.11 110.356 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 62.31 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.51 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 54.4 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.32 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.53 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 53.32 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.445 ' H ' ' HD2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 70.43 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.22 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.522 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 64.23 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.21 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 65.32 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.31 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.23 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 63.13 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.03 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.52 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.45 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 52.23 112.795 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 71.13 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.34 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.48 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.51 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 64.45 110.118 176.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 71.54 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.522 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.51 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 44.31 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.43 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 44.42 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 52.41 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.33 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.01 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.488 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.34 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' HD13 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.53 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.24 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.443 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.42 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 51.33 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 62.22 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.11 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.22 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.33 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.11 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 70.34 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 52.54 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.34 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 73.23 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.12 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 70.24 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.1 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.13 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 55.34 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.42 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.01 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 61.25 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 62.42 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.43 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 72.44 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.42 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.434 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.13 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.22 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 63.42 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 62.11 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.54 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.35 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 71.32 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.1 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.34 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.13 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.43 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 64.14 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.539 HD13 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.22 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.23 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.44 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 54.24 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.35 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.52 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 62.41 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 53.13 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.54 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.11 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.13 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 70.42 110.107 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 63.31 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.1 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.4 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.35 112.339 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 73.3 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 55.01 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 62.45 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.32 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 63.22 109.69 173.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.2 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' TYR . . . . . 0.616 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.3 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 72.11 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 74.31 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 34.12 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.658 HD21 ' HB2' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.02 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.02 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 72.24 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.13 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 43.23 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 45.4 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.736 ' SG ' ' HB3' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 73.11 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.13 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 71.24 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.736 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.22 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ALA . . . . . 0.658 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 72.24 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.24 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 63.24 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.23 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.01 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.616 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.44 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.43 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 71.35 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 25.23 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 54.32 111.563 175.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 61.24 109.111 -173.765 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.738 0.304 . . . . 73.44 110.583 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.18 108.53 2.52 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.497 -1.041 . . . . 74.21 110.497 175.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -63.14 96.33 0.1 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.129 0.972 . . . . 62.43 110.036 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -69.04 132.44 46.63 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.608 0.763 . . . . 61.05 110.367 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -157.0 152.58 26.77 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.861 0.864 . . . . 74.43 109.13 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -93.3 176.74 6.28 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.49 0.716 . . . . 74.51 109.645 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -70.96 -20.9 62.39 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.272 0.629 . . . . 74.42 111.944 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -113.34 27.78 9.31 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.643 0.777 . . . . 72.12 110.873 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.4 m -103.91 130.25 51.5 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.371 -0.603 . . . . 44.24 109.371 175.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -85.13 107.69 17.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.597 0.359 . . . . 71.22 110.146 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.9 mmm -64.69 -26.17 68.26 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.671 0.789 . . . . 71.41 110.357 172.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -84.68 113.73 51.06 Favored Pre-proline 0 CA--C 1.55 0.957 0 N-CA-C 108.347 -0.983 . . . . 72.4 108.347 170.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.86 -36.62 90.13 Favored 'Trans proline' 0 C--N 1.377 2.065 0 C-N-CA 122.913 2.409 . . . . 75.22 112.348 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.576 ' HB3' HD23 ' A' ' 17' ' ' LEU . 15.1 t70 -151.74 109.9 3.73 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.793 -0.818 . . . . 73.15 108.793 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.6 mp -61.51 -27.82 68.87 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.068 0.547 . . . . 75.42 111.048 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.45 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 14' ' ' ASP . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 41.42 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.52 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.562 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.23 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HB2' HD21 ' A' ' 52' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.22 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 55.23 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 53.53 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.412 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 73.41 112.279 167.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 64.51 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.12 109.708 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.51 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 63.42 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.24 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 71.24 110.333 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 64.13 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.42 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.548 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.31 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.548 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.42 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.35 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.32 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 55.14 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 72.0 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.412 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 31.4 m80 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.44 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.33 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.43 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.31 110.148 175.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.13 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 64.32 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 64.22 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 71.14 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 52.54 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.04 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 73.42 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.757 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 34.55 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 63.25 111.716 176.782 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 64.53 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 74.51 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.44 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 72.45 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 65.42 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.42 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 65.4 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 71.52 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.1 112.975 -177.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 71.21 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 62.33 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 71.24 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 63.01 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.43 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 73.33 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.13 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 60.55 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.15 111.546 177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 64.53 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 61.4 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.44 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.04 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 70.31 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.31 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.757 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.43 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.41 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 55.44 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.44 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 50' ' ' ALA . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.34 107.818 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 61.24 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 71.53 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.23 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.31 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 63.22 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 61.44 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.31 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.42 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.01 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.22 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.02 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.14 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 54.25 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.52 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 51.21 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 51.02 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 62.42 109.901 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 50.43 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.432 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 70.25 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.25 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 70.41 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 73.21 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.23 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.31 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.4 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.512 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.596 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 71.22 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.54 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 112' ' ' ASP . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.41 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 72.12 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.2 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.52 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.33 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.21 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 70.43 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.55 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.33 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.15 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.45 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 72.41 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 32.01 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.21 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.04 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.54 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 60.11 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 61.25 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.596 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.43 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 53.44 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.1 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 63.22 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.01 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 70.0 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 52.11 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttm . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.726 -0.842 . . . . 74.35 108.726 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -129.4 68.86 0.54 Allowed Glycine 0 C--N 1.343 0.958 0 O-C-N 123.287 0.367 . . . . 75.24 112.27 -176.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -107.23 -1.9 21.33 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.252 0.621 . . . . 74.51 111.056 169.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -77.82 126.29 30.63 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.314 -0.625 . . . . 72.24 109.314 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -64.41 102.89 0.58 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.804 0.842 . . . . 72.24 109.203 176.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -86.76 118.91 26.47 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.456 0.702 . . . . 74.14 110.001 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -167.23 -50.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.527 1.131 . . . . 74.23 108.462 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -79.63 73.26 6.33 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.457 -0.792 . . . . 74.21 109.425 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.1 t -179.15 159.62 0.98 Allowed 'General case' 0 C--O 1.242 0.683 0 C-N-CA 125.708 1.603 . . . . 72.12 107.75 -178.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -63.46 96.74 0.12 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 121.294 0.569 . . . . 74.14 109.607 174.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.0 mtp -70.05 -30.45 67.71 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.685 -0.689 . . . . 71.34 111.27 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -132.23 152.82 80.8 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 123.754 0.821 . . . . 63.43 110.133 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.14 -51.83 6.95 Favored 'Trans proline' 0 C--N 1.389 2.69 0 C-N-CA 123.249 2.633 . . . . 64.21 112.734 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.579 ' HB3' HD23 ' A' ' 17' ' ' LEU . 15.2 t70 -161.63 111.02 1.56 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.311 0.577 . . . . 75.31 110.203 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.09 -33.15 71.69 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.36 1.064 . . . . 74.15 110.938 -178.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.13 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.42 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 72.21 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.14 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.14 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.45 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 60.14 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 64.44 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.05 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.11 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.43 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.24 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 70.4 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 71.52 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 71.02 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.469 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 64.13 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.31 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 6.5 tp60 -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 63.21 111.508 -176.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 42.1 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 73.22 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.24 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.11 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 71.05 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.11 110.928 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.1 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 62.43 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.33 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 53.14 111.675 -178.084 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.05 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.03 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.538 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.12 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.538 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 63.42 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.793 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.03 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 63.41 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 44.12 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.02 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 63.15 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.22 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.24 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.52 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 52.11 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 53.15 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 53.11 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 53.22 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 61.34 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 73.01 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 72.22 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.23 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 65.41 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.43 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.55 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.34 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 62.24 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 72.15 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.32 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.465 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.03 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.04 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 50.11 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.599 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.43 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.14 111.19 177.333 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 54.11 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.15 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.793 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.15 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.52 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.05 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.04 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 65.14 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 55.13 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.14 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 64.52 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.31 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.12 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.479 ' NZ ' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 71.22 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 73.32 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.51 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.43 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 54.12 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.24 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.3 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 73.2 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 65.54 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.23 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.31 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.12 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.418 ' O ' HG23 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 52.45 110.557 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 63.12 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.406 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.33 112.007 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.14 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.595 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 61.34 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.875 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.02 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.54 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 41.13 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.14 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 71.1 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.42 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.11 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.31 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 61.43 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.42 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.3 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 54.32 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.35 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.554 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 61.4 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.45 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 54.0 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.465 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 71.22 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.12 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.45 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.875 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.24 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 61.54 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.43 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.44 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 60.44 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.55 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 71.43 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.0 mmt . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.593 -0.521 . . . . 60.42 109.593 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.47 99.31 0.72 Allowed Glycine 0 C--N 1.348 1.2 0 O-C-N 123.968 0.792 . . . . 71.35 111.638 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -120.81 18.76 11.84 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.484 0.713 . . . . 53.42 110.767 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -78.06 -7.2 56.62 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.302 0.641 . . . . 64.43 110.295 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -57.1 114.65 2.23 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 124.014 0.926 . . . . 75.25 109.925 174.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -66.09 118.07 9.32 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 124.131 0.894 . . . . 74.22 110.203 -176.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -74.92 77.1 2.16 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.337 1.055 . . . . 63.2 110.16 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 4.2 p80 -172.94 164.77 5.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.84 1.256 . . . . 72.33 109.828 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 p -51.44 92.33 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 125.324 1.45 . . . . 54.14 114.128 -169.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.62 90.34 2.34 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 107.156 -1.424 . . . . 75.42 107.156 168.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 50.9 -76.02 0.01 OUTLIER 'General case' 0 C--N 1.359 0.987 0 C-N-CA 126.634 1.974 . . . . 71.24 111.492 -167.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -109.95 100.52 43.62 Favored Pre-proline 0 N--CA 1.473 0.685 0 N-CA-C 107.792 -1.188 . . . . 71.32 107.792 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.5 -39.03 75.54 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.501 2.801 . . . . 75.52 113.185 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -177.19 112.81 0.09 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.564 1.145 . . . . 74.34 107.993 177.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.502 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -60.97 -33.14 72.74 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 62.32 109.947 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 73.04 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.559 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 42.23 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.24 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 72.51 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HB2' HD11 ' A' ' 52' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 51.22 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.02 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 73.42 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.21 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.425 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 54.31 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 62.31 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 61.44 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 55.3 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 1.6 pp0? -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.24 111.555 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.33 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.54 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 73.31 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.525 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 70.42 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.408 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.01 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.43 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 53.2 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 72.52 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.25 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.425 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 64.04 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.43 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.45 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.05 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.33 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 71.42 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 51.42 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 72.45 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 54.53 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.49 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.11 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.31 111.268 175.546 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.596 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.24 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.22 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 64.14 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.41 109.805 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.34 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.4 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.34 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.12 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.44 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 61.45 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 70.43 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.33 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 71.34 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 70.53 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.424 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 64.54 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.23 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 62.1 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 64.4 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.439 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.44 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 72.2 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.41 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 71.01 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.1 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.495 ' SG ' HD12 ' A' ' 79' ' ' LEU . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.21 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 73.32 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 71.33 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.495 HD12 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.04 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.51 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 62.41 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 73.25 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.33 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.21 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 72.31 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.417 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.33 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 64.02 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.04 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.13 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 72.32 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.558 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.31 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.14 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.24 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.32 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 64.31 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 55.53 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 62.54 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.15 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.33 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.22 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.12 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 106' ' ' VAL . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.22 109.649 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.2 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.488 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 64.45 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.15 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.22 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.42 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 64.3 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 64.23 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.808 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.13 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.23 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 71.54 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.32 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.33 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 62.52 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 51.04 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.808 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 64.54 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.23 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.33 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.45 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 73.21 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.1 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 52.05 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 72.44 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.51 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 72.45 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.33 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.14 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.43 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.42 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.35 111.677 176.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 63.43 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 64.44 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.22 -0.659 . . . . 55.13 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.91 25.58 5.24 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-O 119.93 -0.372 . . . . 61.33 113.033 -176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m170 -74.88 82.01 2.16 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.002 0.521 . . . . 73.02 110.16 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.4 m80 -153.05 152.59 31.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.421 1.488 . . . . 74.34 107.926 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -66.3 140.85 58.14 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 109.51 -0.552 . . . . 75.11 109.51 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -66.65 136.49 55.63 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.301 0.375 . . . . 62.22 110.16 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -80.54 113.66 18.89 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.642 0.777 . . . . 71.3 109.819 -174.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -82.22 61.9 5.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.949 0.881 . . . . 71.43 110.422 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -81.14 19.67 0.89 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.193 0.997 . . . . 74.41 112.909 -172.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -83.52 104.98 14.08 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 107.962 -1.125 . . . . 75.55 107.962 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.0 mmt -65.6 -35.34 80.54 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.193 0.597 . . . . 64.43 111.894 -173.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -96.55 112.3 59.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 108.485 -0.932 . . . . 71.53 108.485 168.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.91 -37.93 18.35 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.503 2.135 . . . . 64.54 111.336 173.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -161.35 113.15 1.8 Allowed 'General case' 0 C--N 1.349 0.585 0 CA-C-N 115.52 -0.764 . . . . 63.42 109.426 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.511 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.66 -34.4 75.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.15 110.072 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 61.25 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.23 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 62.02 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.517 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.24 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.4 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.21 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.33 110.291 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.31 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 64.01 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.31 112.511 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.14 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 53.12 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.55 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 73.53 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.618 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 44.21 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.03 113.019 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 53.14 111.523 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 7.8 tp60 -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.52 111.308 -177.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 63.14 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 73.52 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.35 110.478 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.13 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.45 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 73.31 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.23 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.23 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 71.1 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.33 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.517 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.21 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.33 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.15 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 63.42 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 70.02 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.22 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.51 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.41 109.927 173.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.13 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 70.34 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 71.4 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 75' ' ' GLU . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 60.13 109.979 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.01 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 72.03 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.3 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 65.33 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 73.14 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.13 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.35 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 62.3 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.54 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 72.33 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.44 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 53.2 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 52.03 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.15 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 72.24 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.42 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.44 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.41 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 56' ' ' ARG . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.21 111.169 178.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 64.04 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 72.11 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 63.31 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.24 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.32 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.24 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.417 HG22 HD22 ' A' ' 113' ' ' LEU . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 45.43 112.702 -172.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.41 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.34 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.33 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 42.21 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 65.3 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 51.33 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 73.24 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.53 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.05 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.44 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 54.44 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.12 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 64.44 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 72.32 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 53.11 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 65.2 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 72.21 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 72.1 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 64.45 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 61.44 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 50.13 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.41 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 73.15 111.695 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.02 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.555 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 63.0 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.635 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.41 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 63.34 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 70.15 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.545 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 54.03 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.12 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 50.23 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 64.4 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.544 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 62.11 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.2 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.43 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.545 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.31 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 73.44 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.21 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 50.31 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 44.3 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.03 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 10.32 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.35 110.215 175.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 72.12 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.42 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.635 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.4 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.42 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 74.41 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.23 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 63.44 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 60.22 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.14 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.484 1.275 0 N-CA-C 110.23 -0.285 . . . . 72.12 110.23 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 78.7 60.42 2.62 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 111.116 -0.793 . . . . 62.05 111.116 -173.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -63.62 98.05 0.17 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.638 0.775 . . . . 74.23 109.723 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -99.05 158.82 15.4 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.072 0.949 . . . . 73.54 110.854 -174.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.466 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 33.9 t60 -154.31 156.04 36.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 107.569 -1.271 . . . . 55.43 107.569 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -56.59 130.79 46.69 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 123.368 0.417 . . . . 73.31 110.58 176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -78.6 -18.72 54.14 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.909 0.484 . . . . 64.21 112.174 -170.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -89.35 -1.73 58.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.004 0.522 . . . . 74.44 111.529 172.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 t -89.3 120.39 30.61 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.648 -0.871 . . . . 75.15 108.648 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -86.41 55.06 3.38 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.015 0.912 . . . . 74.5 109.866 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.3 mtt -119.94 -52.33 2.21 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.883 1.273 . . . . 75.13 108.851 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 62.46 143.81 0.07 OUTLIER Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 125.252 1.421 . . . . 61.45 112.64 -172.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.466 ' HG3' ' HB2' ' A' ' 5' ' ' HIS . 14.3 Cg_exo -66.47 -42.03 10.62 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.872 1.714 . . . . 72.4 110.664 171.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 19.0 t0 -179.9 119.43 0.06 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.322 1.049 . . . . 72.41 110.185 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.03 -37.74 80.69 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.408 0.683 . . . . 73.13 111.646 176.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.1 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.21 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 74.43 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.22 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.02 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.14 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.41 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 44.32 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.41 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.04 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.23 109.964 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 55.44 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.14 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 53.3 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.54 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 64.35 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.55 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 70.04 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.15 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.53 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 71.43 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 64.11 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 70.15 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 65.04 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 61.02 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.44 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.22 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 54.51 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 53.33 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.44 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.22 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 42.33 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HA ' HD22 ' A' ' 79' ' ' LEU . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 73.11 111.936 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.44 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.1 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 74.41 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 70.14 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.11 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.01 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.11 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 52.11 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 74.32 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.12 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.55 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.53 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 70.34 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 73.02 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 51.13 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.3 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.32 111.942 -176.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.22 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.54 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.23 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 54.53 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 63.41 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 62.54 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 71.31 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.02 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.31 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 73.13 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 64.54 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 53.0 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 73.21 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 48' ' ' LYS . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 72.33 110.456 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.24 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 55.43 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.469 ' HA ' HD22 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.24 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 61.55 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.637 HG23 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.23 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.11 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.475 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 62.34 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.415 ' HD1' HG13 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 72.01 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 64.23 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 74.01 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.12 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 61.02 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 63.13 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.04 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 65.1 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.439 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.35 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.02 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 64.44 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.33 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 63.22 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.439 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 65.13 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.1 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 72.05 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.527 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 52.55 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.34 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 71.34 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.415 HG13 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.54 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 71.21 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.51 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.43 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.842 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 54.45 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.33 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 63.44 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.469 HD22 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.43 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.23 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.12 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 53.11 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.842 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.31 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 72.33 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 54.44 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.567 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 65.11 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 53.31 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 63.01 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.34 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 128' ' ' MET . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.45 111.481 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 74.42 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 73.51 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 61.0 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 124' ' ' TYR . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.14 111.206 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 63.24 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 42.12 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.44 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.22 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.13 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.003 -0.369 . . . . 71.02 110.003 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 79.19 -90.4 1.21 Allowed Glycine 0 C--N 1.349 1.277 0 CA-C-O 119.782 -0.455 . . . . 73.35 112.821 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.9 p80 40.66 66.41 0.64 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.829 1.652 . . . . 73.23 112.277 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -148.49 -60.6 0.24 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.954 -1.021 . . . . 74.15 109.241 -174.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -162.23 125.83 3.06 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.027 0.931 . . . . 73.12 108.645 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -66.75 89.67 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.902 0.858 . . . . 75.0 109.165 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -74.27 132.8 42.44 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.884 -1.053 . . . . 74.1 111.173 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -143.54 148.69 36.35 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.513 1.125 . . . . 65.23 109.362 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.32 -167.91 2.04 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.702 0.801 . . . . 74.51 109.915 177.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.559 ' HA ' HD11 ' A' ' 15' ' ' LEU . 7.6 t60 -80.73 62.37 4.74 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-O 121.967 0.889 . . . . 73.41 109.052 174.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.29 -25.68 13.23 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.365 1.066 . . . . 72.14 109.466 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.413 HD22 ' HG3' ' A' ' 18' ' ' MET . 1.4 m-20 -67.31 143.83 97.68 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 115.47 -0.786 . . . . 64.34 108.917 173.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -60.6 -27.61 85.14 Favored 'Trans proline' 0 C--N 1.377 2.076 0 C-N-CA 122.665 2.243 . . . . 53.32 112.232 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.533 ' HB3' HD23 ' A' ' 17' ' ' LEU . 33.0 t70 -167.48 102.91 0.51 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.974 0.91 . . . . 74.01 108.586 176.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 10' ' ' HIS . 5.5 mp -62.74 -24.32 67.64 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.336 0.654 . . . . 64.53 111.274 177.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.23 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 71.32 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.413 ' HG3' HD22 ' A' ' 12' ' ' ASN . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 60.5 110.949 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.615 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 73.41 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 72.52 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.53 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.671 ' HE2' ' CD2' ' A' ' 38' ' ' HIS . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.43 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 60.23 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.22 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 64.23 112.008 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.35 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.1 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.14 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 70.52 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.35 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.42 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 61.14 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 52.51 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.521 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 64.42 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 72.02 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.671 ' CD2' ' HE2' ' A' ' 22' ' ' LYS . 44.7 m80 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.41 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.31 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 63.32 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.442 ' OE2' ' HD2' ' A' ' 38' ' ' HIS . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.34 110.963 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 62.52 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 72.33 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 72.13 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HG3' HG11 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.23 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.13 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.32 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.42 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.42 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.495 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.32 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 74.5 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.11 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.23 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 63.34 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.43 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 63.22 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 64.11 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.33 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.41 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.54 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.33 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 51.12 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.44 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 71.54 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.43 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 71.52 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.44 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.52 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 53.51 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 71.45 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.53 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.33 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.656 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.23 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.43 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.53 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 72' ' ' ASP . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.03 110.174 172.578 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.02 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 74.33 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 72.0 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.33 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.32 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.15 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.1 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.412 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 44.22 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 54.21 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 70.22 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.573 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.13 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.656 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.43 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 62.44 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 51.54 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 54.51 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 63.12 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.24 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 52.54 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 41.44 110.274 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.52 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.21 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.24 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.34 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 62.13 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 53.1 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 74.41 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.45 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.33 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.24 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.11 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.705 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 22.14 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.32 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.3 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 72.22 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.473 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.22 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.41 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 61.51 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.705 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 35.31 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 62.32 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.12 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 33.44 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 64.22 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.43 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 34.42 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 70.35 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.3 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.41 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.13 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.22 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.34 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.11 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 70.44 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.13 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 ttp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.897 -0.409 . . . . 52.15 109.897 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.18 83.81 0.35 Allowed Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.462 -0.655 . . . . 73.45 111.462 177.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -72.52 93.8 1.61 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.046 0.538 . . . . 54.12 109.989 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -67.43 110.87 3.78 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 108.45 -0.944 . . . . 74.04 108.45 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -119.59 26.79 9.15 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.845 0.458 . . . . 65.42 111.59 -174.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.0 p-80 -61.32 -24.03 66.14 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 120.886 0.374 . . . . 64.04 110.974 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -72.06 -40.0 68.65 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.681 1.192 . . . . 72.31 111.217 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -102.01 104.05 14.69 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.223 0.609 . . . . 75.15 109.651 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -54.66 100.77 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.658 1.183 . . . . 74.31 112.685 -175.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -148.01 74.86 1.32 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 106.187 -1.783 . . . . 70.32 106.187 178.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.5 ptp -55.38 -36.14 66.07 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.813 1.245 . . . . 65.25 113.804 -165.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -120.15 124.48 27.77 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 107.932 -1.136 . . . . 63.13 107.932 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.73 -44.81 44.25 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.362 2.041 . . . . 73.13 110.69 169.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.49 ' HB3' HD23 ' A' ' 17' ' ' LEU . 10.0 t70 -175.25 117.26 0.16 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 72.24 109.177 176.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.5 mp -57.96 -36.15 72.17 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.3 110.749 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.43 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 62.43 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 70.13 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.461 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 62.15 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.01 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 72.13 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 62.12 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 61.13 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.21 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.01 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.01 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 51.53 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 62.54 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 73.53 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 52.31 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.43 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.54 113.12 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 72.42 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 52.34 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.14 109.833 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.04 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.21 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.42 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 70.43 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 73.12 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.02 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.11 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 73.11 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG3' HG11 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 72.4 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.31 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 64.42 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.42 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB3' HD23 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 62.04 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 72.22 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 71.34 111.279 177.087 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 73.34 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 63.1 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 43.42 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 53.21 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.14 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 42.34 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.21 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 62.23 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 62.33 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.41 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.13 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.52 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD13 ' HE1' ' A' ' 66' ' ' PHE . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.1 112.851 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.45 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.405 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 71.52 111.1 177.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.13 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 63.3 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 72.43 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 72.25 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 63.11 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.14 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 63.32 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 71.34 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 35.41 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.434 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.23 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.54 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.03 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.21 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 63.43 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.24 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.42 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.45 HG23 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 73.21 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.463 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.33 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 54.1 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.33 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.23 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.11 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 62.44 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 54.42 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 54.44 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 52.33 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.42 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.2 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 72.31 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.51 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 63.22 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.41 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 61.14 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 106' ' ' VAL . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 62.02 111.3 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.4 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.4 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 52.44 112.061 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 60.42 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.482 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 70.23 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.21 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 70.55 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.665 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.22 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.11 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 64.21 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 62.35 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.34 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.31 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.22 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.665 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.33 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 61.05 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.23 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.04 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 63.13 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.11 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 32.0 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.4 111.173 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.42 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.31 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.13 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 54.23 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 60.13 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 62.35 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.04 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.11 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.614 0.245 . . . . 61.21 110.645 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.42 53.3 4.78 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.564 -0.289 . . . . 72.25 113.111 -178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -75.19 89.65 2.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 107.828 -1.175 . . . . 71.14 107.828 171.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.21 -63.89 1.14 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.92 0.888 . . . . 71.13 111.297 -170.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -166.54 126.68 1.61 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.606 -0.887 . . . . 75.55 108.606 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.5 91.73 0.08 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 109.704 -0.48 . . . . 71.43 109.704 178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -76.35 115.17 15.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.6 0.76 . . . . 60.4 109.411 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -60.84 117.75 5.81 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 124.122 0.889 . . . . 72.14 109.855 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 p -78.41 -168.31 1.31 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.969 0.908 . . . . 73.02 110.204 175.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -76.31 -171.5 1.79 Allowed 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.971 -0.456 . . . . 72.42 110.094 172.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 78.9 mtp -62.85 -21.78 66.21 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 111.844 0.313 . . . . 71.53 111.844 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.82 121.82 79.47 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 108.069 -1.086 . . . . 75.45 108.069 163.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -47.63 -36.5 25.16 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 123.91 3.073 . . . . 31.43 113.687 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.517 ' HB3' HD23 ' A' ' 17' ' ' LEU . 21.4 t0 -165.43 114.2 1.02 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.069 -0.969 . . . . 73.21 109.206 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.424 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.9 mp -60.37 -32.99 71.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.233 0.613 . . . . 65.32 110.434 177.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 70.15 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.44 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.12 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.609 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.13 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.52 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.23 111.276 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.14 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.23 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.42 111.118 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.05 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.51 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.52 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.23 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.23 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 63.31 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.714 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.31 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.01 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 73.32 111.835 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.714 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 73.55 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 62.24 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 72.02 109.644 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.2 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 71.54 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 70.0 110.615 167.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.13 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 62.44 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.631 HD12 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 62.24 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 52.01 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 51.4 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 73.53 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.42 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.44 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.52 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.21 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.21 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.22 111.707 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 73.12 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.41 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.02 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.1 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.631 HH21 HD12 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.14 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.43 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HD2' ' A' ' 89' ' ' ARG . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.34 110.93 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.14 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.51 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 71.23 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.51 110.282 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 53.52 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.21 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.42 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.54 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 73.31 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.34 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 43.12 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 73.55 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 53.45 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.43 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.414 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.53 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 64.34 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.15 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.642 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 70.12 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.696 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 60.44 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.34 110.676 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 71.25 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.1 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.696 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.21 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.11 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.24 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 55.33 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.14 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.53 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 60.04 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.2 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.402 ' HD2' ' HB1' ' A' ' 58' ' ' ALA . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 63.31 111.101 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.03 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.55 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.24 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 54.24 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 71.54 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.1 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 63.1 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.32 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 73.53 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.31 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.33 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.32 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 64.4 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 33.54 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.475 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 63.44 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.42 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 102' ' ' LYS . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 44.54 109.604 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.475 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 73.05 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.51 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.565 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.53 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.564 ' HB1' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.52 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.711 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.41 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.21 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 62.44 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 73.33 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.33 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.52 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.711 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 62.32 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 73.02 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.32 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 62.2 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 65.34 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 72.52 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 61.14 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.31 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.21 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 74.31 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 64.22 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 72.13 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.14 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.32 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 71.51 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 61.23 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.875 -0.787 . . . . 63.4 108.875 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.72 -76.4 0.37 Allowed Glycine 0 C--N 1.352 1.432 0 O-C-N 123.586 0.554 . . . . 53.11 112.975 -175.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 63.31 22.55 13.37 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 124.272 1.029 . . . . 75.24 111.929 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -88.77 -21.02 24.02 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.925 0.89 . . . . 71.14 109.982 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -96.63 113.74 25.33 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.641 0.776 . . . . 73.4 109.76 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -125.88 116.86 22.2 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.463 0.705 . . . . 60.02 110.666 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -123.73 4.71 8.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.851 0.861 . . . . 74.24 110.788 173.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.95 120.94 22.09 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 75.01 108.841 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 13' ' ' PRO . 13.6 t -166.2 174.93 8.75 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 123.912 0.757 . . . . 61.32 110.848 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -112.04 -175.92 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.938 1.295 . . . . 71.32 109.795 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -50.99 -40.61 58.39 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 124.014 0.926 . . . . 70.31 112.942 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -104.71 99.92 20.82 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 107.92 -1.141 . . . . 75.21 107.92 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 36.1 Cg_exo -60.13 -36.31 89.3 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.738 2.292 . . . . 61.21 113.425 -172.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.513 ' HB3' HD23 ' A' ' 17' ' ' LEU . 12.0 t70 -161.33 124.94 3.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.944 0.777 . . . . 74.25 110.154 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.98 -33.35 74.15 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.335 0.654 . . . . 62.43 110.837 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 55.11 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 62.14 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.32 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.528 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 72.15 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 71.42 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 55.21 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 53.5 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 34.34 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 64.15 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.32 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 51.2 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.52 110.253 173.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 64.34 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.32 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 53.43 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 70.52 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.624 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.34 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 61.13 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.22 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 63.32 110.795 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.33 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 64.51 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.4 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.416 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.41 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.14 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.45 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.507 HG13 HD12 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 65.43 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.41 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.41 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.418 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 63.14 111.922 -178.185 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.22 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HA ' HD13 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 70.15 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 44.11 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.1 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 63.14 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 44.12 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.22 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.52 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 63.21 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.15 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 63.42 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 71.34 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.21 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.22 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 53.21 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 71.4 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 72.5 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.407 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 63.21 112.376 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.02 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 65.22 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 71.33 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.31 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 70.34 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 72.34 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.23 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.23 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.668 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 70.11 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 64.11 111.897 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 63.42 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.668 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.35 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.15 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.22 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 73.21 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 51.35 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.411 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 63.13 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 65.23 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.433 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 74.3 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.21 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.11 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.433 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 41.3 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 73.45 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.52 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.2 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.47 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.14 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 63.41 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.43 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.481 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.33 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 53.01 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.32 111.135 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.24 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.3 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 63.01 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 64.4 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.11 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.31 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 63.34 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.24 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 102' ' ' LYS . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.55 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 54.33 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 74.34 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 63.0 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.717 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.15 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.44 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 60.32 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.21 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 64.25 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 54.13 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.717 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.12 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.13 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.33 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.477 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 53.24 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 64.54 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 65.31 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.23 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.23 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.53 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 54.41 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.683 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.41 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 72.4 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.53 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 71.43 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.01 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.21 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.45 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 110.423 -0.214 . . . . 70.33 110.423 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.97 65.75 3.43 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 120.923 0.18 . . . . 64.23 113.455 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -85.47 -20.0 30.4 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.899 0.48 . . . . 74.43 110.82 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -74.92 -18.47 60.4 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.679 0.791 . . . . 71.21 111.966 -174.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -60.15 116.1 3.96 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.748 0.819 . . . . 74.31 111.03 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -98.21 110.03 22.68 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.503 0.668 . . . . 74.24 110.28 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -76.0 153.67 36.34 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.016 -1.105 . . . . 72.3 108.016 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -46.32 111.38 0.36 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.08 0.952 . . . . 62.22 112.419 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 t -115.12 -178.9 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.005 1.322 . . . . 51.41 109.4 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -83.63 -169.61 2.65 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.312 0.645 . . . . 73.33 110.252 171.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 84.3 mtp -54.97 -31.77 61.04 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.781 0.832 . . . . 71.5 112.012 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -76.43 112.94 24.38 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.004 0.522 . . . . 54.53 109.627 174.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -70.48 -37.67 7.15 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 122.744 2.296 . . . . 70.42 112.305 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -158.89 116.22 2.79 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.424 -0.807 . . . . 73.0 109.352 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.494 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -62.9 -28.84 70.33 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.259 0.624 . . . . 72.04 110.756 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.1 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.55 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.44 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.576 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 64.35 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.53 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.583 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 72.34 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.45 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.43 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.583 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.34 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.44 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.42 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 72.22 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 63.33 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 65.2 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.31 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.476 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 71.1 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.51 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.41 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.542 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.33 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.43 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 63.23 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.03 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 71.24 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.3 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 52.32 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.2 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 61.25 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 50.22 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.33 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 52.21 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 72.14 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 60.44 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 45.41 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.42 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 55.14 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 62.32 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.404 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.43 114.494 -171.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 73.32 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 71.51 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 63.42 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.45 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 71.51 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 61.25 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.41 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.34 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.21 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.415 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 73.42 111.213 -177.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.31 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 64' ' ' LEU . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.04 112.741 -174.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.11 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.22 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 41.42 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 55.1 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.21 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.22 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.597 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.23 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 72.3 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.44 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.678 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 65.44 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.42 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.51 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 73.4 109.911 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.35 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.24 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.3 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 71.24 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.54 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.01 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 52.41 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 63.32 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.24 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 70.34 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.597 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.12 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.593 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.1 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 55.25 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 53.13 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 71.11 111.403 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.34 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.21 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.43 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.34 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.52 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.478 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.45 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 63.53 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.34 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.576 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.1 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.12 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.53 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 63.31 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.34 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.13 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.54 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.32 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 70.33 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.24 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.44 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 65.01 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 63.42 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 62.43 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 63.52 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 72.44 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 33.34 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.03 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.12 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 64.15 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.21 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.52 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 63.44 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 73.05 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 54.31 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 63.33 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 71.54 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 63.15 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.51 109.551 -173.216 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.128 -0.323 . . . . 62.3 110.128 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.46 55.44 0.08 OUTLIER Glycine 0 C--N 1.348 1.195 0 CA-C-N 116.444 -0.343 . . . . 65.55 112.908 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -128.15 130.55 48.26 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.399 -0.963 . . . . 72.43 108.399 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 71.51 7.2 5.95 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.343 1.457 . . . . 63.41 111.038 -174.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -71.89 136.85 47.07 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.443 0.697 . . . . 74.41 110.224 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -157.76 136.97 11.75 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.822 -0.807 . . . . 75.22 108.822 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -67.19 92.48 0.26 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.656 0.741 . . . . 73.11 110.014 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -91.14 170.96 9.59 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.431 -1.259 . . . . 71.42 110.896 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.5 m -78.34 -175.26 4.13 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.985 0.914 . . . . 33.22 112.177 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -54.62 109.68 0.53 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.304 1.841 . . . . 62.41 111.881 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.42 -71.48 0.47 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.345 0.658 . . . . 74.43 110.325 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -62.51 114.22 11.32 Favored Pre-proline 0 C--N 1.354 0.801 0 O-C-N 124.114 0.884 . . . . 74.31 109.199 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -55.3 -30.97 74.75 Favored 'Trans proline' 0 C--N 1.382 2.307 0 C-N-CA 123.555 2.837 . . . . 75.02 112.707 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 17' ' ' LEU . 23.4 t70 -159.55 111.4 2.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.654 0.782 . . . . 72.53 109.072 172.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.42 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.7 mp -61.4 -30.99 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.301 0.64 . . . . 72.55 111.5 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.44 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 62.32 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 64.0 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.11 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.44 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.21 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 71.12 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 63.24 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.451 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.0 m-20 -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 64.41 111.111 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 73.15 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.13 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.32 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.01 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 65.31 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.43 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 63.32 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.41 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.34 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 64.12 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.21 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.728 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.24 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.15 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.31 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.34 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.34 109.879 -179.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.43 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.21 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.41 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 40' ' ' THR . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 62.44 111.492 177.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 73.32 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.42 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 61.42 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.14 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.31 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.43 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 71.22 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 49' ' ' ASP . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 64.02 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 72.24 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.22 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.54 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.728 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.44 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.14 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.54 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 72.14 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.51 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 71.34 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 65.11 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 73.14 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 74.31 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 54.12 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 54.41 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 53.54 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.41 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 70.25 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 65.54 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.44 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.12 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.575 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 64.24 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.54 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.14 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.23 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.477 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 71.14 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.21 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.14 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 70.43 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.477 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 53.11 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 70.14 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.4 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 85' ' ' LYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 54.15 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.54 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.43 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 74.42 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 21.5 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.12 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.575 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.22 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.2 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 53.53 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.413 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 62.31 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.03 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.21 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 52.44 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.22 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 73.15 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.21 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 63.32 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.13 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.11 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.558 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.34 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.481 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 61.23 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.05 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.543 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 71.33 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.3 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 73.23 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.54 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.575 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 54.45 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 71.14 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.453 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.21 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.42 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.54 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 70.03 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 44.02 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.575 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.3 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 72.52 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 53.4 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.33 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 65.14 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 71.2 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 60.13 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.481 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.21 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 63.45 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 71.11 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 64.41 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 61.44 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.13 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 42.25 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.42 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 71.12 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.21 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 110.742 -0.096 . . . . 72.45 110.742 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.23 78.41 0.96 Allowed Glycine 0 C--N 1.351 1.381 0 C-N-CA 123.072 0.367 . . . . 62.32 113.675 -172.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -98.35 111.74 23.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.429 0.692 . . . . 62.12 110.49 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -85.21 -32.0 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.76 0.824 . . . . 71.33 109.668 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -78.47 117.54 19.77 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.437 -0.949 . . . . 71.23 108.437 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -94.04 157.58 16.03 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.518 0.727 . . . . 70.11 110.805 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -61.9 137.47 58.25 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.842 0.857 . . . . 64.02 110.495 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.6 m80 -83.0 68.25 9.42 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.748 0.819 . . . . 74.04 110.131 -177.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.9 t -111.42 42.32 1.7 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.662 0.744 . . . . 42.14 109.174 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -148.61 133.71 18.25 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 107.994 -1.113 . . . . 74.43 107.994 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.7 mtm -62.5 -31.26 71.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.306 0.642 . . . . 71.12 111.615 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -125.88 91.7 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.356 1.063 . . . . 63.23 108.423 169.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.11 -41.76 72.86 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.86 2.373 . . . . 75.11 112.383 -176.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -167.76 112.68 0.68 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.576 -0.898 . . . . 73.41 108.576 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.2 mp -61.5 -31.29 71.27 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 60.14 110.386 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 19' ' ' VAL . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 61.41 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.44 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 50.21 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.612 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.33 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 61.31 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.53 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.493 ' H ' ' HD2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 61.41 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 60.31 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.21 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.34 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 53.25 111.655 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.44 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.04 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.01 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.34 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.31 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.416 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.24 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.14 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 64.5 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.05 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 64.44 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 72.22 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.43 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.21 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 62.03 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 72.41 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 53.13 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.04 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.21 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.612 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.12 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.565 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 53.22 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.21 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HA ' HD22 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 71.13 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.42 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.51 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 61.05 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 46' ' ' ASN . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.15 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.658 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.21 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.3 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 71.45 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 73.34 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.14 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 54.41 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.24 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.24 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.42 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 73.25 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 72.13 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.23 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.41 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.32 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.53 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.04 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.34 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.04 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.12 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.442 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.02 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.21 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.21 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.13 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 72.04 110.392 178.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.44 111.156 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.23 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 65.12 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.12 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.23 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.479 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.23 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 52.22 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.44 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.479 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 63.54 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.424 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.12 111.304 173.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.617 HG23 ' HB2' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 71.1 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.51 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.442 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.1 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 52.32 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.32 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 60.44 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.32 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 73.02 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.43 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 72.2 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.42 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.03 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 72.1 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 43.15 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.21 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 43.42 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.04 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.42 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 72.42 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.457 ' HD1' ' HB1' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 74.23 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 71.42 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 72.45 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.706 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.41 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.34 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.52 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.43 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.02 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.14 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.33 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.706 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 60.21 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 73.35 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.12 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.617 ' HB2' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.22 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 73.51 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.13 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.42 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.43 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 73.2 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 65.32 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 72.2 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.23 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 53.24 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.44 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.35 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.52 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.21 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.44 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 110.463 -0.199 . . . . 60.3 110.463 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.77 108.8 0.39 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.944 -0.862 . . . . 73.21 110.944 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -65.29 119.98 11.92 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.286 0.634 . . . . 72.44 109.562 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -75.25 100.34 4.31 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.222 0.534 . . . . 71.44 109.689 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -128.53 162.73 26.55 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 125.007 1.323 . . . . 73.34 108.791 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -58.13 127.85 34.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.593 0.757 . . . . 71.04 110.524 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -67.99 156.46 37.26 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.187 0.595 . . . . 74.1 111.539 -170.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -81.86 162.69 22.71 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.185 0.994 . . . . 74.01 109.99 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 t -70.04 165.32 22.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.047 0.539 . . . . 70.14 110.498 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -73.78 78.08 1.58 Allowed 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.678 0.791 . . . . 75.04 111.803 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.1 mmm -71.87 -48.78 43.48 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.328 -0.99 . . . . 74.34 108.328 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -69.59 131.78 89.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 114.494 -1.23 . . . . 73.15 108.634 163.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.0 -46.62 32.62 Favored 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 123.117 2.545 . . . . 74.21 113.022 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.521 ' HB3' HD23 ' A' ' 17' ' ' LEU . 33.6 t70 -163.46 114.55 1.4 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.543 0.337 . . . . 52.32 110.507 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.544 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.0 mp -61.69 -36.14 80.04 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.716 0.807 . . . . 74.11 109.92 -176.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.42 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 55.34 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.53 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.548 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 62.24 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.53 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 63.45 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 63.21 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.22 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 55.44 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.13 111.487 174.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.3 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.23 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 55.22 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 61.24 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 71.34 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 72.25 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.13 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.544 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 8.2 tp60 -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.2 111.36 179.16 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 63.31 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.42 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 72.15 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.474 ' HD2' ' OE1' ' A' ' 41' ' ' GLU . 34.7 m170 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.34 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.34 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.1 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.474 ' OE1' ' HD2' ' A' ' 38' ' ' HIS . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.05 110.259 173.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 73.21 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.33 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 51.22 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.33 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 73.21 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 35.24 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.25 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 52.51 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 62.42 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.547 ' HD3' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.32 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 71.33 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HA ' ' HG2' ' A' ' 56' ' ' ARG . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.35 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 62.12 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 53' ' ' TYR . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 65.02 110.139 178.024 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 51.14 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.31 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 73.14 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.22 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.34 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 53.42 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.53 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.24 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.52 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 63.32 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.32 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.34 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 74.4 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.61 HD11 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 72.2 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.51 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 71.3 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.51 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 63.4 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.54 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 72.32 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.15 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.41 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 62.35 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.479 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.41 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 64.2 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.34 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.7 HG23 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 64.3 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 64.21 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.43 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.41 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 73.52 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.05 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 50.2 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.31 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.05 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 64.14 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 63.04 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.4 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.31 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG3' HD11 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 60.21 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.33 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.35 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.449 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.04 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.518 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.4 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 63.1 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 44.14 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.518 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 61.23 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.1 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 102' ' ' LYS . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 73.44 110.807 -171.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.02 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.34 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 71.04 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.773 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 44.54 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.14 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.14 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.12 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.15 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 64.43 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.51 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.773 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.32 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.55 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.44 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.41 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 44.21 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.23 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.53 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.43 110.737 173.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.44 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.1 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 74.34 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 72.4 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.23 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.22 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 65.05 111.757 174.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 71.14 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.22 109.075 175.456 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.338 -0.245 . . . . 64.34 110.338 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.47 49.33 8.25 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.543 -0.623 . . . . 74.31 111.543 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -77.38 135.7 38.36 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.461 0.704 . . . . 72.21 110.075 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -110.52 160.41 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.583 0.753 . . . . 71.23 110.684 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -118.73 39.31 3.53 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 107.299 -1.371 . . . . 54.33 107.299 169.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 m80 73.54 -52.12 0.7 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.968 1.707 . . . . 72.34 111.873 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 t60 62.01 27.86 16.88 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.568 1.147 . . . . 74.4 110.028 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -67.73 88.53 0.24 Allowed 'General case' 0 C--N 1.353 0.759 0 C-N-CA 124.428 1.091 . . . . 71.1 109.707 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -152.87 165.52 35.2 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-N 114.142 -1.39 . . . . 72.22 108.604 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 150.39 5.59 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.751 0.82 . . . . 74.21 110.727 167.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -46.51 -37.97 8.64 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 124.956 1.302 . . . . 73.31 113.303 -171.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -99.77 95.81 4.12 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 107.469 -1.308 . . . . 53.32 107.469 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -61.28 -32.85 90.36 Favored 'Trans proline' 0 C--N 1.381 2.266 0 C-N-CA 122.893 2.395 . . . . 72.22 112.569 -171.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 17' ' ' LEU . 31.5 t70 -151.54 105.77 3.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 114.86 -1.063 . . . . 64.44 108.711 -175.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.8 mp -67.29 -21.85 65.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.851 0.461 . . . . 70.42 110.766 -178.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.05 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.689 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.24 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.54 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.577 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.11 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.43 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.51 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.419 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 63.01 110.395 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 61.44 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.34 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.42 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.419 ' SG ' ' O ' ' A' ' 22' ' ' LYS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.03 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 51.51 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 73.23 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 73.43 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 34.22 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.53 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.53 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.23 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.44 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.54 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.12 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.31 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.3 109.205 173.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 73.42 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 73.2 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.54 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.13 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 71.11 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 71.45 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.577 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 61.33 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 70.34 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.12 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.02 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.574 ' HB3' HD23 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.54 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.648 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.54 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 51.03 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 64.54 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.42 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.11 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.13 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 63.14 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 62.32 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 63.41 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.11 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 52.11 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.51 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.54 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 73.22 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.402 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 41.34 112.096 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 72.12 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 72.11 112.446 -177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 71.34 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 65.14 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 45.25 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 63.24 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 72.41 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 64.21 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HG ' ' HZ ' ' A' ' 83' ' ' PHE . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.03 111.206 173.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 71.23 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.22 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.21 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 71.14 110.312 173.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.44 109.71 -177.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.03 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.33 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 40.44 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 64.2 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 73' ' ' CYS . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.15 110.087 -177.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.3 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.446 ' HD2' ' N ' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.3 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.22 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.3 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.478 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 63.24 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.15 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 71.23 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.3 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 23.22 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 64.44 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.34 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.22 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 53.42 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.15 110.414 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 71.11 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.11 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 65.55 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.12 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 34.14 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 65.54 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.24 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 61.31 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 64.33 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 61.23 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.24 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.44 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.795 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.32 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.34 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 71.32 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.31 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.13 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 64.01 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.795 ' SG ' HD23 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.03 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.31 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.478 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.41 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.02 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.1 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.14 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 64.21 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 72.55 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.43 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 62.25 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.32 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 73.33 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.21 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.43 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 61.34 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.02 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 109.694 -0.484 . . . . 72.43 109.694 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 37.23 3.03 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.292 -0.413 . . . . 72.53 112.833 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 m170 -73.54 114.18 11.49 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 109.501 -0.555 . . . . 74.22 109.501 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -74.81 77.7 2.1 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.948 0.899 . . . . 65.31 109.15 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -128.97 5.99 5.43 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.29 1.036 . . . . 71.22 109.507 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -75.96 90.16 2.98 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.771 0.829 . . . . 71.5 109.974 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -97.72 -48.46 5.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.494 -0.775 . . . . 74.54 109.275 172.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.61 150.41 44.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.228 1.011 . . . . 74.32 109.001 -177.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.1 t -161.58 175.7 11.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.996 0.426 . . . . 61.23 110.573 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -71.97 171.47 11.77 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.85 0.86 . . . . 74.04 111.38 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 mtt -55.62 -50.65 69.58 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.097 0.959 . . . . 62.45 109.952 -178.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -133.72 100.16 13.65 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 106.62 -1.622 . . . . 74.34 106.62 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.33 -33.01 95.42 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 122.366 2.044 . . . . 63.02 111.056 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.525 ' HB3' HD23 ' A' ' 17' ' ' LEU . 20.1 t70 -153.79 108.16 3.07 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 107.543 -1.281 . . . . 64.23 107.543 175.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.503 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.4 mp -57.5 -31.39 65.98 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.394 0.677 . . . . 74.14 110.207 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.62 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 72.21 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 72.44 110.578 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.482 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 71.42 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 65.15 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 61.21 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 64.11 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.32 114.04 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 44.12 112.282 -179.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.41 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 72.14 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.5 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.04 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.23 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 72.12 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.3 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.44 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 71.54 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 60.25 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.652 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 18.9 mm100 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.21 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.14 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.1 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 74.43 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 71.14 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.51 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.14 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.11 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 72.11 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 71.31 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 60.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.43 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.44 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.04 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.21 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.04 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 64.02 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 65.45 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.13 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.01 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 70.13 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 71.15 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 61.34 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 62.45 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.4 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.53 111.841 -174.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.11 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 62.43 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.33 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 70.44 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 71.24 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.4 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.22 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.33 111.887 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 63.54 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.53 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.14 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.42 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 77' ' ' ILE . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.34 111.248 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.03 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.41 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 61.32 110.49 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.24 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 54.03 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 70.04 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 63.1 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.23 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.04 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.6 HG23 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.55 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.42 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 60.23 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.1 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 72.03 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.482 HH21 HG22 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.42 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 72.2 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.12 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.12 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.04 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.43 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.14 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.23 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.34 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.34 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 73.32 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 61.1 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 70.53 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 52.45 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.455 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 64.3 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.518 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 71.21 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.631 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.45 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.43 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.558 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.52 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.631 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.44 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.24 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.44 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 65.22 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.04 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 70.25 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.23 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.631 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 72.23 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 73.41 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.34 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 61.54 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.23 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.2 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 53.54 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.23 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.41 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 72.54 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.631 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.15 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 71.32 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 70.1 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 51.52 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.42 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.22 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtt . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.693 -0.484 . . . . 75.24 109.693 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.86 57.79 7.51 Favored Glycine 0 C--N 1.351 1.414 0 O-C-N 123.529 0.518 . . . . 65.12 112.607 178.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -73.99 145.31 44.7 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.435 0.694 . . . . 73.33 109.505 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 59.04 60.48 2.41 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 108.401 -0.963 . . . . 73.24 108.401 -161.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -76.33 89.77 3.18 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.547 -1.206 . . . . 75.4 109.834 -174.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -66.72 99.33 0.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.721 0.808 . . . . 72.15 110.648 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -137.14 81.77 1.89 Allowed 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.865 0.866 . . . . 71.44 109.061 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.4 m80 -137.79 -160.21 1.04 Allowed 'General case' 0 C--O 1.245 0.842 0 N-CA-C 106.895 -1.52 . . . . 75.33 106.895 171.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -65.82 82.72 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 109.389 -0.597 . . . . 70.44 109.389 170.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -74.01 99.11 3.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.158 0.983 . . . . 63.23 110.894 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 mtm -59.6 -38.49 81.39 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.016 -0.993 . . . . 74.22 110.516 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -70.11 109.89 5.69 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 108.126 -1.065 . . . . 74.03 108.126 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -56.94 -41.05 79.41 Favored 'Trans proline' 0 C--N 1.377 2.064 0 C-N-CA 123.08 2.52 . . . . 72.33 112.033 -177.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.5 ' HB3' HD23 ' A' ' 17' ' ' LEU . 17.6 t70 -162.35 112.72 1.52 Allowed 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.202 -1.036 . . . . 73.34 108.202 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.6 mp -60.25 -30.72 69.61 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.246 0.618 . . . . 75.55 111.076 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.14 112.945 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.54 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 62.45 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 61.31 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.43 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 73.02 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.32 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 64.32 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.22 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.03 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.44 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.02 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 74.35 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.14 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.671 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.31 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.14 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 65.11 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.3 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.31 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 64.45 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 70.55 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.625 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.34 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 63.3 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 72.32 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 62.42 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 34.34 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 64.52 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 61.33 110.505 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 10.1 p30 -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.31 110.961 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 72.21 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.53 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.34 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.11 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.23 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 64.14 111.055 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.24 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.15 112.777 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 44.44 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 71.24 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.04 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 64.11 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 62.24 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.14 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.14 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.22 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.53 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.431 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.21 111.808 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.04 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 62.34 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.24 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 73.35 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 65.53 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.51 HD11 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.01 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 64.22 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.42 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 65.44 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.4 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 64.4 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.2 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.22 110.251 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.441 ' HG2' ' O ' ' A' ' 74' ' ' GLU . 14.0 mm100 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.15 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.43 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 73.34 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.33 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 71.31 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.45 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 72.24 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.32 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 54.23 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.32 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 64.15 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 73.52 110.03 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.24 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.42 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 62.4 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.44 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 102' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.33 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 65.11 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 53.23 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.51 ' HG3' HD11 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 62.13 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.33 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 71.22 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.53 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.44 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.503 ' HB2' HD13 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 64.32 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.2 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.24 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 61.54 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 102' ' ' LYS . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.14 109.397 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.0 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.51 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.35 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 74.14 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 71.33 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.1 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.32 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.42 ' HB3' HD13 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.33 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 51.05 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.22 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.33 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.24 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 63.01 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 53.44 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 64.53 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.31 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.33 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.41 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.417 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 71.13 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 73.15 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 63.41 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 71.15 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.13 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.32 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.14 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.42 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mmt . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.453 -0.573 . . . . 73.15 109.453 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -136.28 -153.3 6.52 Favored Glycine 0 C--N 1.342 0.887 0 N-CA-C 110.797 -0.921 . . . . 50.43 110.797 174.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -99.88 141.71 32.33 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 117.152 0.476 . . . . 74.41 110.999 -177.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -85.47 -16.85 38.27 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 65.42 110.526 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -64.23 86.59 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.483 0.713 . . . . 75.04 110.276 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -139.16 29.01 2.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.798 1.239 . . . . 60.1 109.426 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -85.48 46.16 1.27 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.886 0.85 . . . . 75.15 110.29 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -146.01 34.05 1.01 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.929 1.692 . . . . 73.25 107.572 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 m -64.9 107.39 1.46 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.68 0.792 . . . . 72.13 110.333 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -75.7 -168.04 0.79 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.124 0.97 . . . . 73.34 111.151 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -49.28 -49.52 43.21 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.017 0.927 . . . . 70.05 110.473 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -93.3 111.04 50.26 Favored Pre-proline 0 C--O 1.241 0.608 0 N-CA-C 107.403 -1.332 . . . . 61.2 107.403 161.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.531 ' HG2' HD21 ' A' ' 17' ' ' LEU . 28.0 Cg_endo -61.28 -30.45 88.02 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 122.446 2.098 . . . . 75.42 111.837 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.425 ' HB3' HD23 ' A' ' 17' ' ' LEU . 20.4 t70 -165.45 118.29 1.17 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.317 0.647 . . . . 74.24 110.258 173.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.23 -34.33 73.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.917 0.887 . . . . 72.23 110.735 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 70.31 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 62.53 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.01 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.6 HG11 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.13 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 72.21 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 70.54 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 72.14 110.448 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 71.15 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 51.32 110.105 174.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.45 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.42 112.602 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.33 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 61.24 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 63.15 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.53 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.455 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.33 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.467 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.33 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . 0.503 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.03 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 72.32 111.188 -176.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.455 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 71.34 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.512 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 61.14 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.21 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.3 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.15 111.251 167.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.44 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.32 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.31 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 71.42 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.25 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.6 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.13 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.6 p30 -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.05 111.081 -176.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 53.43 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 51.44 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.51 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.408 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 65.01 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 71.43 110.143 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.03 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 61.33 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 72.13 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.11 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.512 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 71.41 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 50.23 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.23 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.24 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 71.14 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.11 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 55.01 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.429 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 63.12 111.575 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.21 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.43 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 61.51 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.33 108.964 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 70.21 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.33 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 54.41 112.092 -174.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 71.14 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.415 ' SG ' ' HD2' ' A' ' 90' ' ' LYS . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.02 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 72.31 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.11 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.408 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.11 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 72.51 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.32 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 73.02 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.32 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.43 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 53.51 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.54 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.449 HD13 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.23 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 60.13 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.22 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.23 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 64.22 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.404 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.23 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.415 ' HD2' ' SG ' ' A' ' 73' ' ' CYS . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 74.44 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 72.14 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.22 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.34 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 73.31 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.31 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.54 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.45 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.33 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 51.43 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.43 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.3 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.04 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 61.04 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 64.2 111.975 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.24 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 53.33 110.802 -169.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 74.3 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 53.24 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 63.52 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.34 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.667 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 62.22 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 71.04 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.24 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.449 ' HB2' HD13 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 64.23 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 65.01 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.34 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.667 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.43 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.44 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 72.13 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.12 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.53 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 60.4 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.13 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.15 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.23 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 63.32 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 34.14 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.14 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 73.51 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 32.31 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.23 111.224 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 72.43 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.42 108.681 174.615 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.4 mtp . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.116 -0.328 . . . . 74.02 110.116 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.78 24.71 1.17 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-N 116.221 -0.445 . . . . 73.24 112.526 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -81.87 59.27 4.21 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.646 0.736 . . . . 63.12 110.436 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -140.03 143.4 36.39 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.647 1.179 . . . . 74.15 108.125 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -87.39 159.02 18.87 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.967 -0.753 . . . . 73.14 108.967 169.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -71.14 -157.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.565 0.746 . . . . 73.4 109.437 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -53.99 155.45 3.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.647 0.379 . . . . 74.2 111.061 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -54.67 156.89 3.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.486 0.714 . . . . 54.1 110.803 172.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.2 t -56.47 159.94 3.43 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.37 0.668 . . . . 73.1 111.51 -178.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -52.12 152.43 3.23 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.539 0.736 . . . . 74.23 110.861 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -63.31 -14.08 45.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.096 0.958 . . . . 50.14 113.573 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.23 140.9 83.0 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-O 117.965 -1.017 . . . . 54.32 109.446 164.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.494 ' HB2' HD21 ' A' ' 17' ' ' LEU . 9.3 Cg_endo -47.03 -51.76 8.83 Favored 'Trans proline' 0 C--N 1.391 2.791 0 C-N-CA 123.506 2.804 . . . . 74.43 113.194 -168.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.4 t70 -177.86 128.9 0.14 Allowed 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.8 0.687 . . . . 63.44 109.984 164.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.409 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.9 mp -60.32 -30.36 69.45 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.417 0.687 . . . . 65.45 111.88 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.655 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.42 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 71.15 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.2 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 63.52 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.23 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.34 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.12 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.45 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.32 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.51 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.31 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.23 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 72.33 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 63.4 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.21 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' HD21 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 72.03 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 54.13 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 66.6 tp60 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.31 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.604 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 53.44 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.41 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 54.11 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.604 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.42 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 72.34 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 71.2 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.13 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.31 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 53.52 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 45.23 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.44 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.32 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 52.22 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.11 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 71.43 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB2' ' HB2' ' A' ' 79' ' ' LEU . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 63.21 112.725 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 70.4 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 72.24 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 55.14 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.41 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 65.03 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.11 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 72.14 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 60.42 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 73.12 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.22 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.31 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.22 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.4 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 64.42 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.34 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.13 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.55 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.32 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.14 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 62.14 112.614 -174.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.31 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.52 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.532 ' O ' HG22 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.44 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 61.11 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 53.41 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 73.33 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 72.03 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.43 111.141 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.42 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 45.34 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.52 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 72.5 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 71.54 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 74.32 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.13 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.511 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 65.14 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 54.35 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.534 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 72.45 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 64.32 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.51 111.686 -176.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 61.34 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 53.22 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 55.33 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.4 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 72.41 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.15 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.24 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.33 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.11 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.14 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.32 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 43.25 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.711 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 52.51 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 65.02 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.511 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 74.12 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.623 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 63.22 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.42 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 63.25 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.31 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.05 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 62.41 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 71.1 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 63.42 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.22 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 50.2 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.1 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.14 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.13 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.2 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.31 110.312 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.11 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.31 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 64.24 110.234 175.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 61.32 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.11 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.623 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.55 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.711 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 50.54 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 55.45 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.15 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.23 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 52.52 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 43.03 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.465 0.174 . . . . 72.11 111.138 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.18 29.06 67.08 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 119.51 -0.606 . . . . 72.14 114.07 174.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.0 t60 54.64 73.06 0.42 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.191 0.996 . . . . 74.22 109.98 -177.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 46.8 t60 -73.79 -40.1 63.65 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.182 -0.917 . . . . 53.04 110.25 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 -84.3 96.35 8.99 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.911 -0.586 . . . . 75.32 109.995 175.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -86.25 154.49 21.24 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.844 0.858 . . . . 74.3 108.824 169.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.54 98.05 0.08 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.581 0.352 . . . . 62.24 111.151 176.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.9 t60 51.54 57.78 6.2 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.603 1.561 . . . . 73.42 111.779 170.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 t -72.32 89.43 1.22 Allowed 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.313 -0.858 . . . . 75.13 109.594 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -90.34 40.17 1.0 Allowed 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 122.54 1.162 . . . . 73.24 109.955 -178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.4 mtm -93.4 -35.71 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.941 -1.133 . . . . 72.12 107.941 168.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 49.8 82.11 0.25 Allowed Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 124.844 1.258 . . . . 63.23 110.614 -170.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.49 -23.58 70.87 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 122.617 2.211 . . . . 74.0 111.785 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 17' ' ' LEU . 24.7 t70 -170.06 104.68 0.31 Allowed 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.675 0.79 . . . . 71.53 108.913 -177.108 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.417 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.7 mp -61.36 -24.36 66.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.938 0.495 . . . . 63.42 111.571 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.01 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.618 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.2 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.03 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.565 HG11 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 50.42 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 60.03 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 72.4 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.33 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.21 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.01 112.136 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 64.52 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.2 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.41 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.53 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.54 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 55.34 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.43 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.32 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.42 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.599 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 71.43 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 70.43 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 73.11 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 74.43 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.15 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.412 ' O ' HG13 ' A' ' 43' ' ' ILE . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.42 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.35 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.21 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 54.22 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 72.35 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.21 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HG3' HG11 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 60.45 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 62.22 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 24.32 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.13 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.491 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 73.33 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.33 112.354 -177.576 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.491 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 63.4 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.44 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 62.11 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 63.25 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 63.12 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 61.24 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 61.14 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 71.41 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 61.1 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 72.43 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 70.31 111.021 -174.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.21 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.33 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.1 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.404 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 70.45 111.655 -179.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 44.2 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 62.25 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 44.1 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 74.42 109.782 170.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 73.45 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 60.03 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.477 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.44 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.14 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.32 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.588 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.12 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.13 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 55.33 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.3 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 73.12 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.21 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.32 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 64.0 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.641 HG23 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.41 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.421 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 63.42 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 42.14 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 74.52 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.41 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.15 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 72.2 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 55.32 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 63.42 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.22 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 53.3 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 62.22 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 61.41 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.51 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 55.3 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.22 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 71.54 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.23 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.45 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 64.3 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' MET . . . . . 0.511 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 51.54 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.3 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 65.44 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.636 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.31 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 65.44 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 70.54 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . 0.561 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.1 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 64.12 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 72.23 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.55 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.417 ' HB3' HD11 ' A' ' 84' ' ' ILE . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.13 109.964 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.24 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 51.22 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.641 ' SG ' HG23 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 52.32 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 62.04 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.11 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.514 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 63.13 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 43.22 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.24 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 104' ' ' MET . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.34 110.427 176.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 51.54 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.12 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.636 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.22 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.3 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 33.25 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.31 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 63.55 110.838 172.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.41 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 72.41 110.24 176.043 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.599 -0.519 . . . . 73.0 109.599 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.65 -94.36 0.42 Allowed Glycine 0 C--N 1.342 0.912 0 O-C-N 123.489 0.493 . . . . 75.14 114.233 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.4 p-80 -84.72 129.99 34.75 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.34 0.591 . . . . 73.44 112.397 -168.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -149.45 132.19 15.96 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.227 1.811 . . . . 73.24 106.328 167.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -68.72 149.62 48.85 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 117.733 0.242 . . . . 61.14 110.509 -178.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -68.83 167.35 15.74 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.396 0.678 . . . . 75.44 111.353 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -59.89 156.18 14.93 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.412 0.685 . . . . 71.35 111.282 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -67.42 153.27 44.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.906 0.483 . . . . 72.44 111.231 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -60.72 134.38 57.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.988 1.315 . . . . 74.45 112.901 -165.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 53.3 m80 -142.11 152.83 43.63 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.605 1.162 . . . . 72.43 109.16 172.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.2 mtm -58.96 -58.88 6.7 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.488 1.115 . . . . 51.35 109.945 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -132.94 96.28 18.1 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.5 -1.296 . . . . 75.2 107.5 168.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HG3' ' HB2' ' A' ' 10' ' ' HIS . 20.9 Cg_exo -64.03 -37.37 43.41 Favored 'Trans proline' 0 C--N 1.372 1.799 0 C-N-CA 122.286 1.991 . . . . 74.44 110.811 175.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -172.63 113.39 0.27 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.951 -1.022 . . . . 75.3 109.457 -175.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.498 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -60.99 -33.09 72.7 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.329 0.652 . . . . 70.11 110.356 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 62.31 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.51 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 54.4 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.32 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.53 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 53.32 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.445 ' H ' ' HD2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 70.43 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.22 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.522 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 64.23 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.21 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 65.32 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.31 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.23 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 63.13 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.03 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.52 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.45 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 52.23 112.795 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 71.13 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.34 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.48 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.51 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 64.45 110.118 176.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 71.54 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.522 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.51 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 44.31 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.43 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 44.42 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 52.41 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.33 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.01 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.488 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.34 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' HD13 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.53 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.24 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.443 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.42 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 51.33 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 62.22 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.11 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.22 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.33 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.11 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 70.34 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 52.54 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.34 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 73.23 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.12 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 70.24 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.1 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.13 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 55.34 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.42 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.01 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 61.25 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 62.42 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.43 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 72.44 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.42 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.434 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.13 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.22 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 63.42 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 62.11 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.54 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.35 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 71.32 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.1 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.34 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.13 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.43 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 64.14 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.539 HD13 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.22 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.23 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.44 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 54.24 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.35 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.52 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 62.41 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 53.13 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.54 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.11 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.13 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 70.42 110.107 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 63.31 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.1 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.4 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.35 112.339 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 73.3 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 55.01 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 62.45 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.32 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 63.22 109.69 173.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.2 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TYR . . . . . 0.616 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.3 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 72.11 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 74.31 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 34.12 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.658 HD21 ' HB2' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.02 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.02 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 72.24 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.13 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 43.23 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 45.4 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.736 ' SG ' ' HB3' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 73.11 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.13 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 71.24 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.736 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.22 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ALA . . . . . 0.658 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 72.24 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.24 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 63.24 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.23 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.01 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.616 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.44 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.43 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 71.35 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 25.23 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 54.32 111.563 175.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 61.24 109.111 -173.765 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.544 0.732 0 N-CA-C 111.048 0.018 . . . . 75.420000000000002 111.048 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.450000000000003 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 41.420000000000002 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.519999999999996 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.562 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.230000000000004 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HB2' HD21 ' A' ' 52' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.219999999999999 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 55.229999999999997 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 53.530000000000001 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.412 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 73.409999999999997 112.279 167.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 64.510000000000005 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.119999999999997 109.708 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.510000000000005 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 63.420000000000002 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.239999999999995 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 71.239999999999995 110.333 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 64.129999999999995 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.420000000000002 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.548 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.310000000000002 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.548 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.420000000000002 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.349999999999994 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.319999999999993 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 55.140000000000001 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 72.0 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.412 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 79.7 m-70 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.439999999999998 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.329999999999998 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.430000000000007 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.310000000000002 110.148 175.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.129999999999995 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 64.319999999999993 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 64.219999999999999 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 71.140000000000001 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 52.539999999999999 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.040000000000006 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 73.420000000000002 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.757 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 34.549999999999997 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.446 ' H ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 63.25 111.716 176.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 64.530000000000001 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 74.510000000000005 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.439999999999998 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 72.450000000000003 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 65.420000000000002 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.420000000000002 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 65.400000000000006 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 71.519999999999996 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.099999999999994 112.975 -177.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 71.209999999999994 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 62.329999999999998 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 71.239999999999995 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 63.009999999999998 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.430000000000007 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 73.329999999999998 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.129999999999995 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 60.549999999999997 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.150000000000006 111.546 177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 64.530000000000001 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 61.399999999999999 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.439999999999998 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.040000000000006 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 70.310000000000002 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.310000000000002 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.757 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.430000000000007 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.409999999999997 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 55.439999999999998 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.439999999999998 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 50' ' ' ALA . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.340000000000003 107.818 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 61.240000000000002 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 71.530000000000001 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.230000000000004 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.310000000000002 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 63.219999999999999 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 61.439999999999998 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.310000000000002 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.420000000000002 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.010000000000005 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.219999999999999 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.019999999999996 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.140000000000001 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 54.25 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.519999999999996 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 51.210000000000001 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 51.020000000000003 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 62.420000000000002 109.901 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 50.43 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.432 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 70.25 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.25 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 70.409999999999997 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 73.209999999999994 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.230000000000004 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.310000000000002 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.400000000000006 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.512 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.596 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 71.219999999999999 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.540000000000006 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 112' ' ' ASP . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.409999999999997 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 72.120000000000005 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.200000000000003 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.519999999999996 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.329999999999998 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.209999999999994 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 70.430000000000007 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.549999999999997 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.329999999999998 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.150000000000006 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.450000000000003 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 72.409999999999997 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 32.009999999999998 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.209999999999994 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.040000000000006 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.540000000000006 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 60.109999999999999 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 61.25 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.596 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.430000000000007 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 53.439999999999998 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.100000000000001 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 63.219999999999999 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.010000000000005 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 70.0 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 52.109999999999999 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 120.537 0.208 . . . . 74.150000000000006 110.938 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.129999999999995 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.420000000000002 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 72.209999999999994 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.140000000000001 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.140000000000001 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.450000000000003 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 60.140000000000001 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 64.439999999999998 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.049999999999997 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.109999999999999 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.430000000000007 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.239999999999995 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 70.400000000000006 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 71.519999999999996 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 71.019999999999996 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.469 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 64.129999999999995 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.310000000000002 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 63.210000000000001 111.508 -176.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 42.100000000000001 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 73.219999999999999 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.239999999999995 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.109999999999999 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 71.049999999999997 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.109999999999999 110.928 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.099999999999994 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 62.43 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 53.140000000000001 111.675 -178.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.049999999999997 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.030000000000001 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.538 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.120000000000005 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.538 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 63.420000000000002 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.793 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.030000000000001 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 63.409999999999997 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 44.119999999999997 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.019999999999996 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 63.149999999999999 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.219999999999999 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.239999999999995 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.519999999999996 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 52.109999999999999 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 53.149999999999999 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 53.109999999999999 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 53.219999999999999 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 61.340000000000003 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 73.010000000000005 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 72.219999999999999 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.230000000000004 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 65.409999999999997 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.430000000000007 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.549999999999997 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.340000000000003 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 62.240000000000002 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 72.150000000000006 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.319999999999993 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.465 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.030000000000001 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.040000000000006 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 50.109999999999999 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.599 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.430000000000007 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.140000000000001 111.19 177.333 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 54.109999999999999 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.150000000000006 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.793 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.150000000000006 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.519999999999996 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.049999999999997 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.040000000000006 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 65.140000000000001 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 55.130000000000003 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.140000000000001 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 64.519999999999996 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.310000000000002 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.120000000000005 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.479 ' NZ ' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 71.219999999999999 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 73.319999999999993 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.510000000000005 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.430000000000007 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 54.119999999999997 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.239999999999995 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.299999999999997 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 73.200000000000003 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 65.540000000000006 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.230000000000004 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.310000000000002 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.120000000000005 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.418 ' O ' HG23 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 52.450000000000003 110.557 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 63.119999999999997 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.406 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.329999999999998 112.007 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.140000000000001 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.595 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 61.340000000000003 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.875 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.019999999999996 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.540000000000006 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 41.130000000000003 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.140000000000001 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 71.099999999999994 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.420000000000002 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.109999999999999 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.310000000000002 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 61.43 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.420000000000002 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.299999999999997 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 54.32 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.349999999999994 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.554 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 61.399999999999999 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.450000000000003 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 54.0 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.465 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 71.219999999999999 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.120000000000005 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.450000000000003 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.875 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.239999999999995 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 61.539999999999999 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.430000000000007 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.439999999999998 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 60.439999999999998 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.549999999999997 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 71.430000000000007 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 62.32 109.947 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 73.040000000000006 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.559 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 42.229999999999997 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.239999999999995 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 72.510000000000005 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HB2' HD11 ' A' ' 52' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 51.219999999999999 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.019999999999996 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 73.420000000000002 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.209999999999994 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.425 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 54.310000000000002 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 62.310000000000002 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 61.439999999999998 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 55.299999999999997 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.239999999999995 111.555 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.329999999999998 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.540000000000006 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 73.310000000000002 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.525 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 70.420000000000002 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.408 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.010000000000005 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.430000000000007 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 53.200000000000003 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 72.519999999999996 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.25 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.425 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 64.040000000000006 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.430000000000007 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.450000000000003 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.049999999999997 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.329999999999998 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 71.420000000000002 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 51.420000000000002 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 72.450000000000003 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 54.530000000000001 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.49 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.109999999999999 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.310000000000002 111.268 175.546 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.596 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.239999999999995 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.219999999999999 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 64.140000000000001 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.43 HD22 HD13 ' A' ' 52' ' ' LEU . 87.1 m-20 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.409999999999997 109.805 175.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.340000000000003 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.400000000000006 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.340000000000003 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.120000000000005 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.439999999999998 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 61.450000000000003 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 70.430000000000007 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.329999999999998 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 71.340000000000003 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 70.530000000000001 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.424 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 64.540000000000006 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.230000000000004 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 62.100000000000001 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 64.400000000000006 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.439 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.439999999999998 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 72.200000000000003 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.409999999999997 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 71.010000000000005 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.099999999999994 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.495 ' SG ' HD12 ' A' ' 79' ' ' LEU . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.209999999999994 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 73.319999999999993 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 71.329999999999998 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.495 HD12 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.040000000000006 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.43 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.510000000000005 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 62.409999999999997 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 73.25 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.329999999999998 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.209999999999994 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 72.310000000000002 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.417 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.329999999999998 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 64.019999999999996 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.040000000000006 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.129999999999995 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 72.319999999999993 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.558 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.310000000000002 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.140000000000001 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.239999999999995 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.319999999999993 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 64.310000000000002 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 55.530000000000001 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 62.539999999999999 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.150000000000006 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.329999999999998 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.219999999999999 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.120000000000005 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 106' ' ' VAL . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.219999999999999 109.649 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.200000000000003 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.488 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 64.450000000000003 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.150000000000006 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.219999999999999 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.420000000000002 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 64.299999999999997 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 64.230000000000004 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.808 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.129999999999995 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.230000000000004 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 71.540000000000006 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.319999999999993 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.329999999999998 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 62.520000000000003 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 51.039999999999999 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.808 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 64.540000000000006 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.230000000000004 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.329999999999998 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.450000000000003 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 73.209999999999994 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.099999999999994 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 52.049999999999997 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 72.439999999999998 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.510000000000005 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 72.450000000000003 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.329999999999998 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.140000000000001 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.430000000000007 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.420000000000002 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.349999999999994 111.677 176.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 63.43 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 64.439999999999998 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.150000000000006 110.072 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 61.25 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.229999999999997 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 62.020000000000003 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.517 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.239999999999995 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.400000000000006 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.209999999999994 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.329999999999998 110.291 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.310000000000002 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 64.010000000000005 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.310000000000002 112.511 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.140000000000001 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 53.119999999999997 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.549999999999997 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 73.530000000000001 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.618 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 44.210000000000001 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.030000000000001 113.019 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 53.140000000000001 111.523 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.519999999999996 111.308 -177.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 63.140000000000001 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 73.519999999999996 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HD2' HE21 ' A' ' 34' ' ' GLN . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.349999999999994 110.478 175.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.129999999999995 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.450000000000003 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 73.310000000000002 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.230000000000004 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.230000000000004 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 71.099999999999994 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.329999999999998 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.517 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.209999999999994 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.329999999999998 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.150000000000006 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 63.420000000000002 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 70.019999999999996 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.219999999999999 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.510000000000005 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.409999999999997 109.927 173.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.129999999999995 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 70.340000000000003 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 71.400000000000006 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 75' ' ' GLU . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 60.130000000000003 109.979 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.010000000000005 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 72.030000000000001 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.299999999999997 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 65.329999999999998 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 73.140000000000001 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.129999999999995 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.349999999999994 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 62.299999999999997 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.540000000000006 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 72.329999999999998 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.439999999999998 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 53.200000000000003 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 52.030000000000001 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.149999999999999 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 72.239999999999995 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.420000000000002 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.439999999999998 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.409999999999997 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 56' ' ' ARG . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.209999999999994 111.169 178.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 64.040000000000006 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 72.109999999999999 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 63.310000000000002 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.239999999999995 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.319999999999993 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.239999999999995 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.417 HG22 HD22 ' A' ' 113' ' ' LEU . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 45.43 112.702 -172.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.409999999999997 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.340000000000003 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.329999999999998 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 42.210000000000001 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 65.299999999999997 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 51.329999999999998 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 73.239999999999995 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.530000000000001 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.049999999999997 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.439999999999998 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 54.439999999999998 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.120000000000005 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 64.439999999999998 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 72.319999999999993 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 53.109999999999999 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 65.200000000000003 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 72.209999999999994 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 72.099999999999994 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 64.450000000000003 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 61.439999999999998 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 50.130000000000003 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.41 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 73.150000000000006 111.695 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.019999999999996 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.555 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 63.0 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.635 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.409999999999997 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 63.340000000000003 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 70.150000000000006 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.545 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 54.030000000000001 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.120000000000005 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 50.229999999999997 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 64.400000000000006 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.544 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 62.109999999999999 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.200000000000003 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.430000000000007 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.545 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.310000000000002 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 73.439999999999998 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.209999999999994 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 50.310000000000002 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 44.299999999999997 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.030000000000001 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 10.32 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.349999999999994 110.215 175.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 72.120000000000005 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.420000000000002 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.635 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.400000000000006 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.420000000000002 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 74.409999999999997 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.230000000000004 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 63.439999999999998 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 60.219999999999999 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.140000000000001 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 111.646 0.239 . . . . 73.129999999999995 111.646 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.099999999999994 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.209999999999994 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 74.430000000000007 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.219999999999999 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.019999999999996 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.140000000000001 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.409999999999997 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 44.32 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.409999999999997 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.039999999999999 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.230000000000004 109.964 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 55.439999999999998 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.140000000000001 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 53.299999999999997 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.540000000000006 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 64.349999999999994 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.549999999999997 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 70.040000000000006 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.150000000000006 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.53 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 71.430000000000007 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 64.109999999999999 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 70.150000000000006 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 65.040000000000006 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 61.020000000000003 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.439999999999998 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.219999999999999 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 54.509999999999998 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 53.329999999999998 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.439999999999998 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.219999999999999 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 42.329999999999998 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HA ' HD22 ' A' ' 79' ' ' LEU . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 73.109999999999999 111.936 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.439999999999998 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.100000000000001 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 74.409999999999997 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 70.140000000000001 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.109999999999999 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.010000000000005 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.109999999999999 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 52.109999999999999 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 74.319999999999993 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.120000000000005 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.549999999999997 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.53 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 70.340000000000003 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 73.019999999999996 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 51.130000000000003 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.299999999999997 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.319999999999993 111.942 -176.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.219999999999999 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.540000000000006 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.230000000000004 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 54.530000000000001 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 63.409999999999997 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 62.539999999999999 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 71.310000000000002 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.019999999999996 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.310000000000002 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 73.129999999999995 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 64.540000000000006 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 53.0 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 73.209999999999994 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 48' ' ' LYS . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 72.329999999999998 110.456 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.240000000000002 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 55.43 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.469 ' HA ' HD22 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.239999999999995 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 61.549999999999997 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.637 HG23 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.230000000000004 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.109999999999999 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.475 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 62.340000000000003 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.415 ' HD1' HG13 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 72.010000000000005 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 64.230000000000004 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 74.010000000000005 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.120000000000005 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 61.020000000000003 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 63.130000000000003 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.039999999999999 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 65.099999999999994 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.439 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.349999999999994 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.019999999999996 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 64.439999999999998 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.329999999999998 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 63.219999999999999 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.439 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 65.129999999999995 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.099999999999994 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 72.049999999999997 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.527 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 52.549999999999997 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.340000000000003 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 71.340000000000003 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.415 HG13 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.540000000000006 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 71.209999999999994 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.510000000000005 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.430000000000007 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.842 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 54.450000000000003 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.329999999999998 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 63.439999999999998 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.469 HD22 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.430000000000007 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.230000000000004 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.120000000000005 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 53.109999999999999 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.842 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.310000000000002 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 72.329999999999998 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 54.439999999999998 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.567 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 65.109999999999999 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 53.310000000000002 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 63.009999999999998 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.340000000000003 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 128' ' ' MET . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.450000000000003 111.481 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 74.420000000000002 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 73.510000000000005 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 61.0 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 124' ' ' TYR . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.140000000000001 111.206 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 63.240000000000002 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 42.119999999999997 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.439999999999998 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.219999999999999 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 14.9 m120 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.129999999999995 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.345 0.117 . . . . 64.530000000000001 111.274 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.230000000000004 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 71.319999999999993 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 60.5 110.949 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.615 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 73.409999999999997 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 72.519999999999996 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.530000000000001 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.533 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.430000000000007 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 60.229999999999997 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.219999999999999 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.456 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 64.230000000000004 112.008 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.349999999999994 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.099999999999994 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.140000000000001 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 70.519999999999996 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.349999999999994 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.420000000000002 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 tp60 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 61.140000000000001 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 52.509999999999998 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.521 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 64.420000000000002 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 72.019999999999996 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.471 ' ND1' ' HE2' ' A' ' 22' ' ' LYS . 93.1 m-70 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.409999999999997 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.310000000000002 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 63.32 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.340000000000003 110.963 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 62.520000000000003 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 72.329999999999998 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 72.129999999999995 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HG3' HG11 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.230000000000004 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.130000000000003 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.319999999999993 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.420000000000002 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.420000000000002 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.495 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.319999999999993 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 74.5 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.109999999999999 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.230000000000004 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 63.340000000000003 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.430000000000007 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 63.219999999999999 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 64.109999999999999 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.329999999999998 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.409999999999997 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.540000000000006 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.329999999999998 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 51.119999999999997 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.439999999999998 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 71.540000000000006 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.430000000000007 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 71.519999999999996 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.439999999999998 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.519999999999996 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 53.509999999999998 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 71.450000000000003 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.530000000000001 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.329999999999998 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.656 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.430000000000007 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.530000000000001 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 72' ' ' ASP . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.030000000000001 110.174 172.578 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.019999999999996 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 74.329999999999998 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 72.0 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.329999999999998 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.319999999999993 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.150000000000006 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.099999999999994 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.412 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 44.219999999999999 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 54.210000000000001 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 70.219999999999999 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.573 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.129999999999995 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.656 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.430000000000007 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 62.439999999999998 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 51.539999999999999 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 54.509999999999998 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 63.119999999999997 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.240000000000002 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 52.539999999999999 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 41.439999999999998 110.274 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.519999999999996 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.209999999999994 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.239999999999995 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.340000000000003 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 62.130000000000003 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 53.100000000000001 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 74.409999999999997 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.450000000000003 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.329999999999998 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.239999999999995 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.109999999999999 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.705 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 22.140000000000001 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.299999999999997 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 72.219999999999999 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.473 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.219999999999999 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.409999999999997 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 61.509999999999998 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.705 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 35.310000000000002 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 62.32 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.120000000000005 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 33.439999999999998 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 64.219999999999999 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.430000000000007 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 34.420000000000002 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 70.349999999999994 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.299999999999997 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.409999999999997 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.129999999999995 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.219999999999999 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.340000000000003 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.109999999999999 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 70.439999999999998 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.8 m120 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.129999999999995 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.299999999999997 110.749 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.430000000000007 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 62.43 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 70.129999999999995 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.461 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 62.149999999999999 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.010000000000005 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 72.129999999999995 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 62.119999999999997 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 61.130000000000003 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.209999999999994 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.009999999999998 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.010000000000005 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 51.530000000000001 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 62.539999999999999 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 73.530000000000001 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 52.310000000000002 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.430000000000007 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.540000000000006 113.12 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 72.420000000000002 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 52.340000000000003 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.140000000000001 109.833 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.040000000000006 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.209999999999994 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.420000000000002 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 70.430000000000007 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 73.120000000000005 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.019999999999996 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.109999999999999 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 73.109999999999999 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG3' HG11 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 72.400000000000006 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.310000000000002 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 64.420000000000002 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.420000000000002 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB3' HD23 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 62.039999999999999 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 72.219999999999999 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 71.340000000000003 111.279 177.087 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.469 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 73.340000000000003 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 63.100000000000001 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 43.420000000000002 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 53.210000000000001 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.140000000000001 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 42.340000000000003 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.209999999999994 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 62.229999999999997 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 62.329999999999998 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.409999999999997 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.129999999999995 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.519999999999996 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD13 ' HE1' ' A' ' 66' ' ' PHE . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.100000000000001 112.851 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.450000000000003 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.405 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 71.519999999999996 111.1 177.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.129999999999995 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 63.299999999999997 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 72.430000000000007 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 72.25 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 63.109999999999999 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.140000000000001 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 63.32 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 71.340000000000003 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 35.409999999999997 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.434 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.230000000000004 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.540000000000006 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.030000000000001 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.209999999999994 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 63.43 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.239999999999995 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.420000000000002 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.45 HG23 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 73.209999999999994 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.463 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.329999999999998 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 54.100000000000001 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.329999999999998 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.230000000000004 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.109999999999999 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 62.439999999999998 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.482 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 54.420000000000002 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 54.439999999999998 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 52.329999999999998 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.420000000000002 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.200000000000003 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 72.310000000000002 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.510000000000005 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 63.219999999999999 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.409999999999997 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 61.140000000000001 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 106' ' ' VAL . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 62.020000000000003 111.3 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.400000000000006 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.4 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 52.439999999999998 112.061 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 60.420000000000002 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.482 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 70.230000000000004 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.209999999999994 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 70.549999999999997 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.665 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.219999999999999 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.109999999999999 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 64.209999999999994 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 62.350000000000001 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.340000000000003 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.310000000000002 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.219999999999999 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.665 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.329999999999998 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 61.049999999999997 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.230000000000004 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.040000000000006 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 63.130000000000003 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.109999999999999 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 32.0 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.400000000000006 111.173 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.420000000000002 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.310000000000002 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.129999999999995 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 54.229999999999997 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 60.130000000000003 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 62.350000000000001 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.040000000000006 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.109999999999999 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 121.121 0.486 . . . . 65.319999999999993 110.434 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 70.150000000000006 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.439999999999998 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.120000000000005 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.609 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.129999999999995 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.519999999999996 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.431 HD21 HD12 ' A' ' 17' ' ' LEU . 90.5 m-20 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.230000000000004 111.276 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.140000000000001 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.230000000000004 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.420000000000002 111.118 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.049999999999997 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.510000000000005 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.519999999999996 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.230000000000004 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.230000000000004 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 63.310000000000002 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.714 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.310000000000002 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.010000000000005 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 73.319999999999993 111.835 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.714 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 73.549999999999997 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 62.240000000000002 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 72.019999999999996 109.644 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.200000000000003 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 71.540000000000006 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 70.0 110.615 167.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.129999999999995 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 62.439999999999998 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.631 HD12 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 62.240000000000002 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 52.009999999999998 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 51.399999999999999 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 73.530000000000001 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.420000000000002 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.439999999999998 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.52 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.209999999999994 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.209999999999994 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.219999999999999 111.707 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 73.120000000000005 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.409999999999997 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.019999999999996 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.099999999999994 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.631 HH21 HD12 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.140000000000001 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.430000000000007 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HD2' ' A' ' 89' ' ' ARG . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.340000000000003 110.93 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.140000000000001 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.510000000000005 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 71.230000000000004 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.510000000000005 110.282 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 53.520000000000003 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.209999999999994 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.420000000000002 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.540000000000006 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 73.310000000000002 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.340000000000003 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 43.119999999999997 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 73.549999999999997 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 53.450000000000003 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.430000000000007 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.414 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.530000000000001 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 64.340000000000003 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.150000000000006 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.642 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 70.120000000000005 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.696 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 60.439999999999998 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.451 HE21 HG23 ' A' ' 77' ' ' ILE . 22.8 mm-40 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.340000000000003 110.676 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 71.25 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.696 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.209999999999994 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.109999999999999 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.239999999999995 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 55.329999999999998 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.140000000000001 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.530000000000001 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 60.039999999999999 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.200000000000003 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.402 ' HD2' ' HB1' ' A' ' 58' ' ' ALA . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 63.310000000000002 111.101 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.030000000000001 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.549999999999997 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.239999999999995 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 54.240000000000002 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 71.540000000000006 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.099999999999994 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 63.100000000000001 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.319999999999993 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 73.530000000000001 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.310000000000002 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.329999999999998 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.319999999999993 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 64.400000000000006 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 33.539999999999999 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.475 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 63.439999999999998 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.420000000000002 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 102' ' ' LYS . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 44.539999999999999 109.604 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.475 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 73.049999999999997 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.510000000000005 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.565 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.530000000000001 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.564 ' HB1' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.519999999999996 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.711 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.409999999999997 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.209999999999994 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 62.439999999999998 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 73.329999999999998 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.329999999999998 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.520000000000003 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.711 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 62.32 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 73.019999999999996 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.319999999999993 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 62.200000000000003 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 65.340000000000003 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 72.519999999999996 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 61.140000000000001 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.310000000000002 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.209999999999994 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 74.310000000000002 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 64.219999999999999 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 72.129999999999995 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.140000000000001 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.319999999999993 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 71.510000000000005 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 61.229999999999997 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.77 0.319 . . . . 62.43 110.837 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 55.109999999999999 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 62.140000000000001 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.319999999999993 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.528 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 72.150000000000006 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 71.420000000000002 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.411 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 55.210000000000001 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 53.5 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 34.340000000000003 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 64.150000000000006 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.319999999999993 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 51.200000000000003 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.519999999999996 110.253 173.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 64.340000000000003 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.319999999999993 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 53.43 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 70.519999999999996 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.624 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.340000000000003 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 61.130000000000003 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.219999999999999 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 63.32 110.795 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.329999999999998 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 64.510000000000005 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.400000000000006 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.416 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.409999999999997 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.140000000000001 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.450000000000003 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.507 HG13 HD12 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 65.430000000000007 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.409999999999997 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.409999999999997 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.418 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 63.140000000000001 111.922 -178.185 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.219999999999999 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HA ' HD13 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 70.150000000000006 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 44.109999999999999 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.099999999999994 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 63.140000000000001 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 44.119999999999997 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.219999999999999 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 63.210000000000001 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.150000000000006 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 63.420000000000002 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 71.340000000000003 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.209999999999994 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.219999999999999 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 53.210000000000001 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 71.400000000000006 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 72.5 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.407 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 63.210000000000001 112.376 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.019999999999996 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 65.219999999999999 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 71.329999999999998 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.310000000000002 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 70.340000000000003 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 72.340000000000003 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.230000000000004 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.230000000000004 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.668 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 70.109999999999999 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 64.109999999999999 111.897 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 63.420000000000002 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.668 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.349999999999994 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.150000000000006 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.219999999999999 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 73.209999999999994 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 51.350000000000001 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.411 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 63.130000000000003 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 65.230000000000004 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.433 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 74.299999999999997 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.209999999999994 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.433 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 41.299999999999997 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 73.450000000000003 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.519999999999996 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.200000000000003 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.47 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.140000000000001 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 63.409999999999997 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.430000000000007 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.481 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.329999999999998 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 53.009999999999998 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.319999999999993 111.135 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.239999999999995 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.299999999999997 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 63.009999999999998 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 64.400000000000006 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.109999999999999 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.310000000000002 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 63.340000000000003 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.239999999999995 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 102' ' ' LYS . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.549999999999997 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 54.329999999999998 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 74.340000000000003 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 63.0 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.717 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.149999999999999 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.439999999999998 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 60.32 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.209999999999994 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 64.25 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 54.130000000000003 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.717 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.120000000000005 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.129999999999995 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.329999999999998 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.477 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 53.240000000000002 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 64.540000000000006 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 65.310000000000002 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.230000000000004 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.230000000000004 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.530000000000001 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 54.409999999999997 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.683 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.409999999999997 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 72.400000000000006 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.530000000000001 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 71.430000000000007 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.010000000000005 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.209999999999994 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.8 m120 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.450000000000003 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.145 0.498 . . . . 72.040000000000006 110.756 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.099999999999994 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.549999999999997 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.439999999999998 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.576 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 64.349999999999994 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.530000000000001 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.583 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 72.340000000000003 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.450000000000003 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.430000000000007 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.583 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.340000000000003 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.439999999999998 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.420000000000002 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 72.219999999999999 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 63.329999999999998 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 65.200000000000003 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.310000000000002 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.476 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 71.099999999999994 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.509999999999998 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.409999999999997 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.542 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.329999999999998 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.430000000000007 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 63.229999999999997 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.030000000000001 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 71.239999999999995 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.299999999999997 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 52.32 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.200000000000003 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 61.25 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 50.219999999999999 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.329999999999998 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 52.210000000000001 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 72.140000000000001 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 60.439999999999998 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 45.409999999999997 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.420000000000002 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 55.140000000000001 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 62.32 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.404 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.430000000000007 114.494 -171.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 73.319999999999993 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 71.510000000000005 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 63.420000000000002 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.450000000000003 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 71.510000000000005 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 61.25 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.409999999999997 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.340000000000003 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.209999999999994 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.415 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 73.420000000000002 111.213 -177.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.310000000000002 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 64' ' ' LEU . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.040000000000006 112.741 -174.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.109999999999999 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 41.420000000000002 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 55.100000000000001 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.209999999999994 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.219999999999999 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.597 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.230000000000004 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 72.299999999999997 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.439999999999998 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.678 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 65.439999999999998 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.420000000000002 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.510000000000005 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 73.400000000000006 109.911 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.349999999999994 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.239999999999995 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.299999999999997 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 71.239999999999995 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.540000000000006 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.010000000000005 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 52.409999999999997 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 63.32 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.239999999999995 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 70.340000000000003 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.597 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.120000000000005 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.593 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.099999999999994 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 55.25 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 53.130000000000003 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 71.109999999999999 111.403 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.340000000000003 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.209999999999994 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.430000000000007 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.340000000000003 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.519999999999996 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.478 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.450000000000003 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 63.530000000000001 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.340000000000003 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.576 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.099999999999994 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.119999999999997 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.530000000000001 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 63.310000000000002 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.340000000000003 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.129999999999995 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.540000000000006 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.319999999999993 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 70.329999999999998 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.239999999999995 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.439999999999998 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 65.010000000000005 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 63.420000000000002 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 62.43 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 63.520000000000003 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 72.439999999999998 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 33.340000000000003 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.030000000000001 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.120000000000005 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 64.150000000000006 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.209999999999994 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.519999999999996 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 63.439999999999998 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 73.049999999999997 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 54.310000000000002 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 63.329999999999998 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 71.540000000000006 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 63.149999999999999 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.510000000000005 109.551 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 111.5 0.185 . . . . 72.549999999999997 111.5 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.439999999999998 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 62.32 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 64.0 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.109999999999999 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.439999999999998 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.209999999999994 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 71.120000000000005 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 63.240000000000002 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.451 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 0.9 OUTLIER -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 64.409999999999997 111.111 177.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 73.150000000000006 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.130000000000003 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.319999999999993 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.010000000000005 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 65.310000000000002 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.430000000000007 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 63.32 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.409999999999997 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.340000000000003 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 64.120000000000005 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.210000000000001 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.728 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.239999999999995 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.150000000000006 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.310000000000002 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.340000000000003 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.340000000000003 109.879 -179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.430000000000007 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.209999999999994 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.409999999999997 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 40' ' ' THR . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 62.439999999999998 111.492 177.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 73.319999999999993 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.420000000000002 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 61.420000000000002 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.140000000000001 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.310000000000002 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.430000000000007 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 71.219999999999999 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 49' ' ' ASP . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 64.019999999999996 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 72.239999999999995 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.219999999999999 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.540000000000006 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.728 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.439999999999998 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.140000000000001 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.540000000000006 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 72.140000000000001 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.510000000000005 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 71.340000000000003 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 65.109999999999999 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 73.140000000000001 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 74.310000000000002 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 54.119999999999997 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 54.409999999999997 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 53.539999999999999 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.409999999999997 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 70.25 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 65.540000000000006 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.439999999999998 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.120000000000005 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.575 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 64.239999999999995 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.540000000000006 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.140000000000001 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.230000000000004 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.477 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 71.140000000000001 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.209999999999994 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.140000000000001 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 70.430000000000007 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.477 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 53.109999999999999 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 70.140000000000001 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.400000000000006 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 85' ' ' LYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 54.149999999999999 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.539999999999999 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.430000000000007 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 74.420000000000002 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 21.5 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.120000000000005 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.575 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.219999999999999 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.200000000000003 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 53.530000000000001 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.413 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 62.310000000000002 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.030000000000001 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.209999999999994 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 52.439999999999998 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.219999999999999 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 73.150000000000006 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.209999999999994 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 63.32 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.129999999999995 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.109999999999999 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.558 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.340000000000003 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.481 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 61.229999999999997 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.049999999999997 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.543 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 71.329999999999998 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.299999999999997 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 73.230000000000004 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.540000000000006 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.575 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 54.450000000000003 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 71.140000000000001 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.453 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.209999999999994 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.420000000000002 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.54 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 70.030000000000001 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 44.020000000000003 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.575 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.299999999999997 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 72.519999999999996 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 53.399999999999999 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.329999999999998 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 65.140000000000001 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 71.200000000000003 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 60.130000000000003 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.481 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.209999999999994 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 63.450000000000003 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 71.109999999999999 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 64.409999999999997 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 61.439999999999998 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.129999999999995 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 42.25 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.420000000000002 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 71.120000000000005 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.209999999999994 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 60.140000000000001 110.386 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 19' ' ' VAL . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 61.409999999999997 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.439999999999998 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 50.210000000000001 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.612 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.329999999999998 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 61.310000000000002 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.530000000000001 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.493 ' HD2' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 61.409999999999997 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 60.310000000000002 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.209999999999994 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.340000000000003 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 53.25 111.655 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.439999999999998 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.040000000000006 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.010000000000005 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.310000000000002 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.416 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.239999999999995 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.140000000000001 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 64.5 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.049999999999997 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 64.439999999999998 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 72.219999999999999 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.430000000000007 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 62.030000000000001 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 72.409999999999997 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 53.130000000000003 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.040000000000006 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.209999999999994 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.612 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.120000000000005 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.565 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 53.219999999999999 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.209999999999994 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HA ' HD22 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 71.129999999999995 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.420000000000002 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.509999999999998 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 61.049999999999997 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 46' ' ' ASN . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.150000000000006 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.658 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.209999999999994 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.299999999999997 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 71.450000000000003 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 73.340000000000003 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.140000000000001 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 54.409999999999997 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.239999999999995 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.239999999999995 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.420000000000002 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 73.25 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 72.129999999999995 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.230000000000004 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.409999999999997 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.319999999999993 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.530000000000001 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.040000000000006 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.340000000000003 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.040000000000006 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.120000000000005 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.442 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.019999999999996 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.209999999999994 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.209999999999994 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.130000000000003 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.409 HG23 HE21 ' A' ' 78' ' ' GLN . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 72.040000000000006 110.392 178.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.409 HE21 HG23 ' A' ' 77' ' ' ILE . 27.4 mm-40 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.439999999999998 111.156 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 65.120000000000005 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.120000000000005 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.230000000000004 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.479 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.230000000000004 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 52.219999999999999 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.439999999999998 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . 0.479 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 63.539999999999999 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.424 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.120000000000005 111.304 173.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.617 HG23 ' HB2' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 71.099999999999994 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.510000000000005 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.442 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.099999999999994 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 52.32 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.319999999999993 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 60.439999999999998 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.319999999999993 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 73.019999999999996 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.430000000000007 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 72.200000000000003 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.420000000000002 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.030000000000001 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 72.099999999999994 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 43.149999999999999 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.209999999999994 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 43.420000000000002 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.040000000000006 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.420000000000002 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 72.420000000000002 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.457 ' HD1' ' HB1' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 74.230000000000004 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 71.420000000000002 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 72.450000000000003 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.706 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.409999999999997 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.340000000000003 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.519999999999996 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.430000000000007 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.019999999999996 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.140000000000001 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.329999999999998 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.706 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 60.210000000000001 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 73.349999999999994 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.120000000000005 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.617 ' HB2' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.219999999999999 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 73.510000000000005 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.129999999999995 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.420000000000002 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.43 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 73.200000000000003 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 65.319999999999993 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 72.200000000000003 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.230000000000004 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 53.240000000000002 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.439999999999998 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.349999999999994 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.519999999999996 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.209999999999994 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.6 m120 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.439999999999998 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 121.084 0.468 . . . . 74.109999999999999 109.92 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.420000000000002 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 55.340000000000003 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.530000000000001 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.548 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 62.240000000000002 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.530000000000001 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 63.450000000000003 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 63.210000000000001 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.219999999999999 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 55.439999999999998 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.521 ' SG ' ' HD2' ' A' ' 38' ' ' HIS . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.130000000000003 111.487 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.299999999999997 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.230000000000004 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 55.219999999999999 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 61.240000000000002 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 71.340000000000003 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 72.25 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.129999999999995 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.544 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.200000000000003 111.36 179.16 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 63.310000000000002 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.420000000000002 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 72.150000000000006 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.521 ' HD2' ' SG ' ' A' ' 26' ' ' CYS . 23.1 m-70 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.340000000000003 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.340000000000003 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.099999999999994 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.049999999999997 110.259 173.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 73.209999999999994 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.329999999999998 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 51.219999999999999 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.329999999999998 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 73.209999999999994 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 35.240000000000002 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.25 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 52.509999999999998 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 62.420000000000002 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.547 ' HD3' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.319999999999993 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 71.329999999999998 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HA ' ' HG2' ' A' ' 56' ' ' ARG . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.350000000000001 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 62.119999999999997 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 53' ' ' TYR . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 65.019999999999996 110.139 178.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 51.140000000000001 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.310000000000002 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 73.140000000000001 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.219999999999999 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.340000000000003 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 53.420000000000002 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.530000000000001 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.239999999999995 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.519999999999996 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 63.32 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.319999999999993 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.340000000000003 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 74.400000000000006 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.61 HD11 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 72.200000000000003 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.510000000000005 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 71.299999999999997 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.510000000000005 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 63.399999999999999 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.540000000000006 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 72.319999999999993 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.150000000000006 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.409999999999997 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 62.350000000000001 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.479 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.409999999999997 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 64.200000000000003 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.340000000000003 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.7 HG23 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 64.299999999999997 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 64.209999999999994 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.430000000000007 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.409999999999997 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 73.519999999999996 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.049999999999997 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 50.200000000000003 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.310000000000002 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.049999999999997 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 64.140000000000001 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 63.039999999999999 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.400000000000006 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.310000000000002 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG3' HD11 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 60.210000000000001 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.329999999999998 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.349999999999994 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.449 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.040000000000006 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.518 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.400000000000006 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 63.100000000000001 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 44.140000000000001 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.518 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 61.229999999999997 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.099999999999994 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 102' ' ' LYS . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 73.439999999999998 110.807 -171.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.019999999999996 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.340000000000003 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 71.040000000000006 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.773 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 44.539999999999999 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.140000000000001 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.140000000000001 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.120000000000005 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.150000000000006 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 64.430000000000007 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.510000000000005 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.773 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.319999999999993 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.549999999999997 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.439999999999998 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.409999999999997 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 44.210000000000001 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.230000000000004 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.530000000000001 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.421 ' HE1' ' HE2' ' A' ' 104' ' ' MET . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.430000000000007 110.737 173.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.439999999999998 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.099999999999994 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 74.340000000000003 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 72.400000000000006 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.230000000000004 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.219999999999999 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 65.049999999999997 111.757 174.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 71.140000000000001 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.219999999999999 109.075 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 N--CA 1.477 0.919 0 CA-C-O 120.653 0.264 . . . . 70.420000000000002 110.766 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.049999999999997 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.689 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.239999999999995 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.540000000000006 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.577 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.109999999999999 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.430000000000007 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.510000000000005 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 63.009999999999998 110.395 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 61.439999999999998 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.340000000000003 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.420000000000002 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.030000000000001 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 51.509999999999998 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 73.230000000000004 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 73.430000000000007 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 34.219999999999999 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.530000000000001 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.530000000000001 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.230000000000004 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.439999999999998 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.539999999999999 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.120000000000005 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.310000000000002 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.458 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 78.7 m-70 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.299999999999997 109.205 173.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 73.420000000000002 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 73.200000000000003 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.540000000000006 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.129999999999995 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 71.109999999999999 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 71.450000000000003 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.577 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 61.329999999999998 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 70.340000000000003 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.120000000000005 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.019999999999996 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.574 ' HB3' HD23 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.540000000000006 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.648 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.540000000000006 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 51.030000000000001 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 64.540000000000006 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.420000000000002 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.109999999999999 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.129999999999995 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 63.140000000000001 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 62.32 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 63.409999999999997 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.109999999999999 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 52.109999999999999 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.510000000000005 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.540000000000006 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 73.219999999999999 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.402 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 41.340000000000003 112.096 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 72.120000000000005 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 72.109999999999999 112.446 -177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 71.340000000000003 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 65.140000000000001 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 45.25 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 63.240000000000002 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 72.409999999999997 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 64.209999999999994 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HG ' ' HZ ' ' A' ' 83' ' ' PHE . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.030000000000001 111.206 173.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 71.230000000000004 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.219999999999999 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.209999999999994 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 71.140000000000001 110.312 173.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.404 HE21 HG23 ' A' ' 77' ' ' ILE . 28.1 mm-40 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.439999999999998 109.71 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.030000000000001 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.329999999999998 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 40.439999999999998 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 64.200000000000003 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 73' ' ' CYS . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.150000000000006 110.087 -177.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.299999999999997 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.446 ' HD2' ' N ' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.299999999999997 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.219999999999999 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.299999999999997 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.478 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 63.240000000000002 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.150000000000006 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 71.230000000000004 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.299999999999997 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 23.219999999999999 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 64.439999999999998 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.340000000000003 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.219999999999999 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 53.420000000000002 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.150000000000006 110.414 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 71.109999999999999 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.109999999999999 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 65.549999999999997 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.120000000000005 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 34.140000000000001 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 65.540000000000006 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.240000000000002 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 61.310000000000002 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 64.329999999999998 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 61.229999999999997 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.239999999999995 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.439999999999998 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.795 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.319999999999993 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.340000000000003 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 71.319999999999993 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.310000000000002 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.129999999999995 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 64.010000000000005 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.795 ' SG ' HD23 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.030000000000001 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.310000000000002 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.478 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.409999999999997 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.019999999999996 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.099999999999994 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.140000000000001 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 64.209999999999994 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 72.549999999999997 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.430000000000007 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 62.25 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.319999999999993 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 73.329999999999998 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.209999999999994 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.430000000000007 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 61.340000000000003 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.019999999999996 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.4 mp . . . . . 0 CA--C 1.548 0.873 0 CA-C-O 121.418 0.628 . . . . 74.140000000000001 110.207 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.62 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 72.209999999999994 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 72.439999999999998 110.578 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.482 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 71.420000000000002 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 65.150000000000006 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 61.210000000000001 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 64.109999999999999 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.319999999999993 114.04 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 44.119999999999997 112.282 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.409999999999997 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 72.140000000000001 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.5 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.040000000000006 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.230000000000004 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 72.120000000000005 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.439999999999998 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 71.540000000000006 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 60.25 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.652 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 37.7 mm-40 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.209999999999994 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.140000000000001 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.099999999999994 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 74.430000000000007 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 71.140000000000001 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.510000000000005 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.140000000000001 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.109999999999999 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 72.109999999999999 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 71.310000000000002 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 60.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.430000000000007 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.439999999999998 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.040000000000006 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.209999999999994 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.040000000000006 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 64.019999999999996 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 65.450000000000003 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.129999999999995 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.010000000000005 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 70.129999999999995 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 71.150000000000006 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 61.340000000000003 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 62.450000000000003 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.400000000000006 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.530000000000001 111.841 -174.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.109999999999999 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 62.43 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.329999999999998 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 70.439999999999998 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 71.239999999999995 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.399999999999999 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.329999999999998 111.887 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 63.539999999999999 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.530000000000001 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.420000000000002 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 77' ' ' ILE . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.340000000000003 111.248 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.030000000000001 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.409999999999997 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 61.32 110.49 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.239999999999995 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 54.030000000000001 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 70.040000000000006 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 63.100000000000001 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.230000000000004 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.040000000000006 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.6 HG23 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.549999999999997 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.420000000000002 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 60.229999999999997 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.099999999999994 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 72.030000000000001 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.482 HH21 HG22 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.420000000000002 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 72.200000000000003 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.120000000000005 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.120000000000005 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.040000000000006 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.430000000000007 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.140000000000001 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.229999999999997 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.340000000000003 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.340000000000003 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 73.319999999999993 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 61.100000000000001 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 70.530000000000001 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 52.450000000000003 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.455 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 64.299999999999997 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.518 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 71.209999999999994 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.631 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.450000000000003 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.430000000000007 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.558 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.519999999999996 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.631 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.439999999999998 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.239999999999995 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.439999999999998 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 65.219999999999999 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.040000000000006 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 70.25 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.230000000000004 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.631 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 72.230000000000004 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 73.409999999999997 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.340000000000003 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 61.539999999999999 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.230000000000004 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.200000000000003 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 53.539999999999999 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.230000000000004 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.409999999999997 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 72.540000000000006 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.631 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.150000000000006 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 71.319999999999993 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 70.099999999999994 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 51.520000000000003 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.420000000000002 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.219999999999999 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.6 mp . . . . . 0 CA--C 1.547 0.862 0 CA-C-O 121.311 0.577 . . . . 75.549999999999997 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.140000000000001 112.945 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.540000000000006 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 62.450000000000003 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 61.310000000000002 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.430000000000007 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 73.019999999999996 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.319999999999993 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 64.319999999999993 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.219999999999999 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.030000000000001 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.019999999999996 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 74.349999999999994 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.140000000000001 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.671 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.310000000000002 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.140000000000001 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 65.109999999999999 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.299999999999997 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.310000000000002 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 64.450000000000003 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 70.549999999999997 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.625 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.340000000000003 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 63.299999999999997 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 72.319999999999993 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 62.420000000000002 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 34.340000000000003 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 64.519999999999996 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 61.329999999999998 110.505 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.310000000000002 110.961 179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 72.209999999999994 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.530000000000001 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.340000000000003 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.109999999999999 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.230000000000004 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.479 ' HG ' HD21 ' A' ' 46' ' ' ASN . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 64.140000000000001 111.055 178.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.239999999999995 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.150000000000006 112.777 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 44.439999999999998 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 71.239999999999995 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.039999999999999 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 64.109999999999999 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 62.240000000000002 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.140000000000001 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.140000000000001 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.219999999999999 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.530000000000001 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.431 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.209999999999994 111.808 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.040000000000006 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 62.340000000000003 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.239999999999995 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 73.349999999999994 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 65.530000000000001 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.51 HD11 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.010000000000005 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 64.219999999999999 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.420000000000002 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 65.439999999999998 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.400000000000006 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 64.400000000000006 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.200000000000003 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.468 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.219999999999999 110.251 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.468 HE21 HG23 ' A' ' 77' ' ' ILE . 27.7 mm-40 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.150000000000006 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 73.340000000000003 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.329999999999998 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 71.310000000000002 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.450000000000003 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 72.239999999999995 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.319999999999993 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 54.229999999999997 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.319999999999993 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 64.150000000000006 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 73.519999999999996 110.03 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.239999999999995 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.420000000000002 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 62.399999999999999 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.439999999999998 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 102' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.329999999999998 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 65.109999999999999 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 53.229999999999997 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.51 ' HG3' HD11 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 62.130000000000003 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.329999999999998 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 71.219999999999999 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.530000000000001 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.439999999999998 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.503 ' HB2' HD13 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 64.319999999999993 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.200000000000003 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.239999999999995 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 61.539999999999999 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 102' ' ' LYS . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.140000000000001 109.397 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.0 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.510000000000005 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.349999999999994 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 74.140000000000001 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 71.329999999999998 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.099999999999994 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.319999999999993 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.42 ' HB3' HD13 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.329999999999998 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 51.049999999999997 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.219999999999999 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.329999999999998 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.239999999999995 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 63.009999999999998 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 53.439999999999998 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 64.530000000000001 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.310000000000002 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.329999999999998 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.409999999999997 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.417 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 71.129999999999995 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 73.150000000000006 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 63.409999999999997 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 71.150000000000006 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.129999999999995 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.319999999999993 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.140000000000001 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.420000000000002 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 121.157 0.503 . . . . 72.230000000000004 110.735 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 70.310000000000002 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 62.530000000000001 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.009999999999998 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.6 HG11 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.130000000000003 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 72.209999999999994 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 70.540000000000006 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 72.140000000000001 110.448 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 71.150000000000006 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 51.32 110.105 174.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.450000000000003 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.420000000000002 112.602 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.329999999999998 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 61.240000000000002 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 63.149999999999999 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.530000000000001 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.455 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.329999999999998 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.467 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.329999999999998 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . 0.503 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.030000000000001 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.454 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.1 OUTLIER -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 72.319999999999993 111.188 -176.874 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.455 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 71.340000000000003 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.512 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 61.140000000000001 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.209999999999994 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.299999999999997 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.150000000000006 111.251 167.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.439999999999998 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.319999999999993 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.310000000000002 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 71.420000000000002 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.25 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.6 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.129999999999995 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.411 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.3 OUTLIER -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.049999999999997 111.081 -176.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 53.43 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 51.439999999999998 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.510000000000005 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.408 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 65.010000000000005 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 71.430000000000007 110.143 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.030000000000001 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 61.329999999999998 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 72.129999999999995 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.109999999999999 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.512 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 71.409999999999997 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 50.229999999999997 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.229999999999997 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.239999999999995 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 71.140000000000001 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 55.009999999999998 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.429 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 63.119999999999997 111.575 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.210000000000001 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.430000000000007 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 61.509999999999998 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.329999999999998 108.964 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 70.209999999999994 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.329999999999998 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 54.409999999999997 112.092 -174.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 71.140000000000001 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.415 ' SG ' ' HD2' ' A' ' 90' ' ' LYS . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.019999999999996 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 72.310000000000002 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.109999999999999 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.408 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.109999999999999 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 72.510000000000005 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.319999999999993 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 73.019999999999996 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.319999999999993 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.430000000000007 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 53.509999999999998 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.540000000000006 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.449 HD13 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.230000000000004 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 60.130000000000003 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.219999999999999 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.230000000000004 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 64.219999999999999 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.404 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.415 ' HD2' ' SG ' ' A' ' 73' ' ' CYS . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 74.439999999999998 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 72.140000000000001 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.219999999999999 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.340000000000003 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 73.310000000000002 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.310000000000002 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.540000000000006 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.450000000000003 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.329999999999998 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 51.43 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.430000000000007 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.299999999999997 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.040000000000006 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 61.039999999999999 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 64.200000000000003 111.975 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.240000000000002 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 53.329999999999998 110.802 -169.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 74.299999999999997 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 53.240000000000002 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 63.520000000000003 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.340000000000003 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.667 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 62.219999999999999 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 71.040000000000006 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.239999999999995 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.449 ' HB2' HD13 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 64.230000000000004 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 65.010000000000005 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.340000000000003 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.667 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.430000000000007 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.439999999999998 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 72.129999999999995 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.120000000000005 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.530000000000001 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 60.399999999999999 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.129999999999995 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.150000000000006 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.230000000000004 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 63.32 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 34.140000000000001 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.140000000000001 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 73.510000000000005 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 32.310000000000002 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.230000000000004 111.224 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 72.430000000000007 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.420000000000002 108.681 174.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.9 mp . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 111.88 0.326 . . . . 65.450000000000003 111.88 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.655 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.420000000000002 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 71.150000000000006 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.200000000000003 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 63.520000000000003 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.229999999999997 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.340000000000003 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.120000000000005 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.450000000000003 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.319999999999993 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.510000000000005 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.310000000000002 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.230000000000004 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 72.329999999999998 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 63.399999999999999 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.209999999999994 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' HD21 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 72.030000000000001 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 54.130000000000003 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 9.7 tp-100 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.310000000000002 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.604 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 53.439999999999998 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.409999999999997 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 54.109999999999999 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.604 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.420000000000002 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 72.340000000000003 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 71.200000000000003 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.130000000000003 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.310000000000002 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 53.520000000000003 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 45.229999999999997 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.439999999999998 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.319999999999993 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 52.219999999999999 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.109999999999999 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 71.430000000000007 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB2' ' HB2' ' A' ' 79' ' ' LEU . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 63.210000000000001 112.725 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HB2' ' HE2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 70.400000000000006 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 72.239999999999995 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 55.140000000000001 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.409999999999997 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 65.030000000000001 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.109999999999999 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 72.140000000000001 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 60.420000000000002 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 73.120000000000005 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.219999999999999 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.310000000000002 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.219999999999999 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.400000000000006 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 64.420000000000002 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.340000000000003 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.129999999999995 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.549999999999997 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.319999999999993 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.140000000000001 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 62.140000000000001 112.614 -174.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.310000000000002 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.519999999999996 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.532 ' O ' HG22 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.439999999999998 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 61.109999999999999 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 53.409999999999997 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 73.329999999999998 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 72.030000000000001 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.430000000000007 111.141 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.420000000000002 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 45.340000000000003 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.519999999999996 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 72.5 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 71.540000000000006 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 74.319999999999993 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.130000000000003 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.511 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 65.140000000000001 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 54.350000000000001 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.534 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 72.450000000000003 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 64.319999999999993 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.425 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.510000000000005 111.686 -176.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 61.340000000000003 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 53.219999999999999 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 55.329999999999998 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.400000000000006 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 72.409999999999997 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.150000000000006 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.239999999999995 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.329999999999998 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.109999999999999 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.140000000000001 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.319999999999993 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 43.25 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.711 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 52.509999999999998 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 65.019999999999996 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.511 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 74.120000000000005 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.623 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 63.219999999999999 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.420000000000002 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 63.25 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.310000000000002 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.049999999999997 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 62.409999999999997 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 71.099999999999994 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 63.420000000000002 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.219999999999999 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 50.200000000000003 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.099999999999994 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.140000000000001 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.129999999999995 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.200000000000003 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.310000000000002 110.312 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.109999999999999 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.310000000000002 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 64.239999999999995 110.234 175.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 61.32 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.109999999999999 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.623 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.549999999999997 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.711 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 50.539999999999999 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 55.450000000000003 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.150000000000006 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.230000000000004 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 52.520000000000003 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 43.030000000000001 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 111.571 0.211 . . . . 63.420000000000002 111.571 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.009999999999998 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.618 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.200000000000003 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.030000000000001 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.565 HG11 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 50.420000000000002 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 60.030000000000001 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 72.400000000000006 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.329999999999998 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.209999999999994 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.010000000000005 112.136 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 64.519999999999996 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.200000000000003 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.409999999999997 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.530000000000001 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.540000000000006 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 55.340000000000003 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.430000000000007 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.319999999999993 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.420000000000002 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.599 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 71.430000000000007 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 70.430000000000007 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 73.109999999999999 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 74.430000000000007 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.150000000000006 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.412 ' O ' HG13 ' A' ' 43' ' ' ILE . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.420000000000002 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.349999999999994 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.209999999999994 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 54.219999999999999 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 72.349999999999994 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.209999999999994 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HG3' HG11 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 60.450000000000003 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 62.219999999999999 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 24.32 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.129999999999995 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.491 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 73.329999999999998 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.329999999999998 112.354 -177.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.491 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 63.399999999999999 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.439999999999998 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 62.109999999999999 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 63.25 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 63.119999999999997 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 61.240000000000002 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 61.140000000000001 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 71.409999999999997 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 61.100000000000001 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 72.430000000000007 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 70.310000000000002 111.021 -174.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.209999999999994 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.329999999999998 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.099999999999994 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.404 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 70.450000000000003 111.655 -179.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 44.200000000000003 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 62.25 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 44.100000000000001 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 74.420000000000002 109.782 170.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 73.450000000000003 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 60.030000000000001 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.477 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.439999999999998 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.140000000000001 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.319999999999993 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.588 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.120000000000005 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.129999999999995 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 55.329999999999998 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.299999999999997 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 73.120000000000005 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.209999999999994 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.32 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 64.0 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.641 HG23 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.409999999999997 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.421 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 63.420000000000002 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 42.140000000000001 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 74.519999999999996 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.409999999999997 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.150000000000006 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 72.200000000000003 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 55.32 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 63.420000000000002 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.219999999999999 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 53.299999999999997 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 62.219999999999999 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 61.409999999999997 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.510000000000005 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 55.299999999999997 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.219999999999999 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 71.540000000000006 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.230000000000004 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.450000000000003 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 64.299999999999997 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . 0.511 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 51.539999999999999 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.299999999999997 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 65.439999999999998 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.636 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.310000000000002 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 65.439999999999998 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 70.540000000000006 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . 0.561 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.099999999999994 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 64.120000000000005 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 72.230000000000004 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.549999999999997 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.417 ' HB3' HD11 ' A' ' 84' ' ' ILE . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.129999999999995 109.964 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.240000000000002 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 51.219999999999999 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.641 ' SG ' HG23 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 52.32 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 62.039999999999999 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.109999999999999 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.514 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 63.130000000000003 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 43.219999999999999 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.239999999999995 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 104' ' ' MET . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.340000000000003 110.427 176.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 51.539999999999999 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.120000000000005 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.636 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.219999999999999 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.299999999999997 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 33.25 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.310000000000002 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 63.549999999999997 110.838 172.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.409999999999997 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 72.409999999999997 110.24 176.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mp . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 121.063 0.459 . . . . 70.109999999999999 110.356 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 62.310000000000002 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.510000000000005 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 54.399999999999999 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.319999999999993 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.530000000000001 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 53.32 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HD2' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 70.430000000000007 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.219999999999999 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.522 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 64.230000000000004 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.209999999999994 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 65.319999999999993 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.310000000000002 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.230000000000004 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 63.130000000000003 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.030000000000001 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.519999999999996 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.450000000000003 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 52.229999999999997 112.795 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 71.129999999999995 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.340000000000003 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.48 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.510000000000005 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 64.450000000000003 110.118 176.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 71.540000000000006 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.522 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.510000000000005 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 44.310000000000002 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.430000000000007 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 44.420000000000002 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 52.409999999999997 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.329999999999998 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.010000000000005 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.488 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.340000000000003 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' HD13 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.530000000000001 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.239999999999995 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.443 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.420000000000002 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 51.329999999999998 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 62.219999999999999 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.109999999999999 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.219999999999999 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.329999999999998 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.109999999999999 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 70.340000000000003 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 52.539999999999999 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 73.230000000000004 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.120000000000005 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 70.239999999999995 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.099999999999994 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.129999999999995 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 55.340000000000003 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.420000000000002 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.010000000000005 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 61.25 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 62.420000000000002 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.430000000000007 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 72.439999999999998 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.420000000000002 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.434 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.130000000000003 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.219999999999999 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 63.420000000000002 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 62.109999999999999 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.540000000000006 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.349999999999994 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 71.319999999999993 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.099999999999994 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.340000000000003 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.129999999999995 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.430000000000007 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 64.140000000000001 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.539 HD13 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.219999999999999 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.230000000000004 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.439999999999998 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 54.240000000000002 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.349999999999994 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.519999999999996 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 62.409999999999997 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 53.130000000000003 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.540000000000006 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.109999999999999 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.129999999999995 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 70.420000000000002 110.107 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 63.310000000000002 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.099999999999994 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.4 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.349999999999994 112.339 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 73.299999999999997 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 55.009999999999998 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 62.450000000000003 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.319999999999993 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 63.219999999999999 109.69 173.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.200000000000003 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' TYR . . . . . 0.616 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.299999999999997 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 72.109999999999999 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 74.310000000000002 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 34.119999999999997 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.658 HD21 ' HB2' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.019999999999996 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.019999999999996 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 72.239999999999995 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.129999999999995 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 43.229999999999997 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 45.399999999999999 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.736 ' SG ' ' HB3' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 73.109999999999999 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.129999999999995 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 71.239999999999995 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.736 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.219999999999999 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ALA . . . . . 0.658 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 72.239999999999995 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.239999999999995 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 63.240000000000002 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.230000000000004 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.010000000000005 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.616 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.430000000000007 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 71.349999999999994 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 25.23 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 54.32 111.563 175.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 61.240000000000002 109.111 -173.765 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.4 mtt . . . . . 0 N--CA 1.489 1.48 0 CA-C-O 120.738 0.304 . . . . 73.439999999999998 110.583 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -72.18 108.53 2.52 Favored Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.497 -1.041 . . . . 74.209999999999994 110.497 175.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -63.14 96.33 0.1 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.129 0.972 . . . . 62.43 110.036 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -69.04 132.44 46.63 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.608 0.763 . . . . 61.049999999999997 110.367 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -157.0 152.58 26.77 Favored 'General case' 0 C--O 1.241 0.609 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 109.13 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 -93.3 176.74 6.28 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 123.49 0.716 . . . . 74.510000000000005 109.645 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -70.96 -20.9 62.39 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.272 0.629 . . . . 74.420000000000002 111.944 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -113.34 27.78 9.31 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.643 0.777 . . . . 72.120000000000005 110.873 178.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.4 m -103.91 130.25 51.5 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.371 -0.603 . . . . 44.240000000000002 109.371 175.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -85.13 107.69 17.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 122.597 0.359 . . . . 71.219999999999999 110.146 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.9 mmm -64.69 -26.17 68.26 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.671 0.789 . . . . 71.409999999999997 110.357 172.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -84.68 113.73 51.06 Favored Pre-proline 0 CA--C 1.55 0.957 0 N-CA-C 108.347 -0.983 . . . . 72.400000000000006 108.347 170.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -59.86 -36.62 90.13 Favored 'Trans proline' 0 C--N 1.377 2.065 0 C-N-CA 122.913 2.409 . . . . 75.219999999999999 112.348 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.576 ' HB3' HD23 ' A' ' 17' ' ' LEU . 15.1 t70 -151.74 109.9 3.73 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 108.793 -0.818 . . . . 73.150000000000006 108.793 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.43 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.6 mp -61.51 -27.82 68.87 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.068 0.547 . . . . 75.420000000000002 111.048 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.07 -26.42 68.83 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.065 0.546 . . . . 71.450000000000003 112.079 176.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' A' ' 14' ' ' ASP . 1.2 pp -84.86 -21.28 29.84 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.714 -0.476 . . . . 41.420000000000002 109.714 175.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.6 mmt -82.84 -34.22 26.9 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 122.537 0.335 . . . . 73.519999999999996 110.866 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.562 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.3 p -69.53 -31.15 47.96 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 123.506 0.722 . . . . 74.230000000000004 110.791 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.542 ' HB2' HD21 ' A' ' 52' ' ' LEU . 17.2 ptpt -75.98 -34.51 59.78 Favored 'General case' 0 C--N 1.352 0.696 0 N-CA-C 109.931 -0.396 . . . . 75.219999999999999 109.931 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.85 -45.35 89.89 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.138 0.575 . . . . 55.229999999999997 110.823 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -74.96 -24.68 58.49 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 116.225 -0.443 . . . . 53.530000000000001 110.801 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.412 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -59.12 -47.2 91.93 Favored Glycine 0 C--N 1.347 1.192 0 O-C-N 123.424 0.453 . . . . 73.409999999999997 112.279 167.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -68.94 -32.55 72.24 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.642 0.777 . . . . 64.510000000000005 111.723 176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.55 -36.41 68.23 Favored 'General case' 0 C--N 1.357 0.912 0 N-CA-C 109.708 -0.478 . . . . 55.119999999999997 109.708 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 87.5 m -58.48 -48.47 80.68 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 123.736 0.648 . . . . 72.510000000000005 110.396 177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -55.29 -45.71 76.23 Favored 'General case' 0 CA--C 1.554 1.116 0 CA-C-N 114.626 -1.17 . . . . 63.420000000000002 110.799 174.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -63.46 -22.31 66.81 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 114.225 -1.352 . . . . 75.239999999999995 111.963 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -73.54 -7.71 52.97 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.19 -0.943 . . . . 71.239999999999995 110.333 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.53 40.58 3.38 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.358 -1.097 . . . . 64.129999999999995 110.358 -177.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -126.91 148.33 50.04 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.085 0.954 . . . . 74.420000000000002 109.726 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.548 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 23.2 m-85 -124.78 -60.24 0.03 OUTLIER Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 123.814 0.846 . . . . 71.310000000000002 110.877 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.548 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 51.9 Cg_endo -65.2 -51.65 1.45 Allowed 'Trans proline' 0 C--N 1.398 3.147 0 C-N-CA 121.471 1.447 . . . . 75.420000000000002 112.317 -172.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -64.0 -34.63 78.43 Favored 'General case' 0 C--N 1.352 0.685 0 N-CA-C 110.141 -0.318 . . . . 73.349999999999994 110.141 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.6 -35.73 72.89 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.789 0.836 . . . . 74.319999999999993 110.783 174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mtp -68.97 -36.79 78.29 Favored 'General case' 0 C--N 1.36 1.059 0 C-N-CA 122.956 0.502 . . . . 55.140000000000001 109.791 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -76.06 -26.05 56.17 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.06 0.85 . . . . 72.0 110.557 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.412 ' HB3' ' HA2' ' A' ' 23' ' ' GLY . 79.7 m-70 -74.27 -29.63 61.75 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 123.625 0.578 . . . . 54.439999999999998 110.314 172.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -75.31 -35.24 61.27 Favored 'General case' 0 C--O 1.212 -0.889 0 CA-C-N 116.489 -0.323 . . . . 72.329999999999998 110.163 170.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.452 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.2 m -68.53 -38.64 81.02 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.062 0.545 . . . . 74.430000000000007 111.03 -178.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -74.51 -27.5 60.57 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.148 -0.316 . . . . 75.310000000000002 110.148 175.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.87 -33.03 73.96 Favored 'General case' 0 C--N 1.352 0.708 0 C-N-CA 122.744 0.418 . . . . 73.129999999999995 110.379 171.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.93 -33.79 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.259 1.023 . . . . 64.319999999999993 109.902 173.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.0 mmtt -68.32 -19.31 64.66 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 120.725 0.298 . . . . 64.219999999999999 110.966 177.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.9 mmt180 -95.24 -34.68 12.12 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.286 1.034 . . . . 71.140000000000001 111.058 176.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.16 82.18 12.05 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 123.745 0.818 . . . . 52.539999999999999 111.206 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.02 -28.82 23.5 Favored 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 122.523 2.149 . . . . 73.040000000000006 113.009 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -76.44 -15.9 59.81 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.884 0.474 . . . . 73.420000000000002 110.953 -177.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.32 93.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.043 0.937 . . . . 72.25 109.063 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.757 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -74.23 -36.51 63.93 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.661 0.784 . . . . 34.549999999999997 112.604 -171.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.446 ' H ' ' HD3' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.77 -18.22 63.85 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 111.716 0.265 . . . . 63.25 111.716 176.782 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -71.38 -36.59 71.46 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.133 0.573 . . . . 64.530000000000001 111.24 171.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -68.06 -26.22 65.74 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.151 0.58 . . . . 74.510000000000005 111.673 173.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.5 m -60.54 -33.36 72.55 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.544 0.738 . . . . 73.439999999999998 111.993 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -69.43 -38.55 77.91 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.803 -0.635 . . . . 72.450000000000003 110.697 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.4 mtp85 -59.33 -50.16 75.05 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.643 0.777 . . . . 65.420000000000002 109.814 174.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -59.42 -37.75 78.86 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.038 0.935 . . . . 73.420000000000002 111.855 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.37 -29.42 68.95 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.84 0.856 . . . . 65.400000000000006 112.129 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 68.7 m -80.93 -41.66 22.57 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 122.768 0.427 . . . . 71.519999999999996 110.938 177.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 19.7 m-85 -56.33 -27.14 54.82 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.55 0.74 . . . . 74.099999999999994 112.975 -177.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 75.8 p -58.26 -48.97 78.76 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 122.818 0.447 . . . . 71.209999999999994 110.056 174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.441 ' HG3' ' CE2' ' A' ' 32' ' ' TYR . 75.4 mmtt -66.9 -31.19 71.62 Favored 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 114.992 -1.003 . . . . 62.329999999999998 110.72 -175.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 74.4 mt -91.4 3.78 54.09 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.828 -1.078 . . . . 71.239999999999995 111.678 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 63.48 21.76 12.91 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.568 0.747 . . . . 63.009999999999998 111.819 178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -100.68 44.52 1.01 Allowed 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.878 1.271 . . . . 73.430000000000007 109.423 175.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 85.9 m-85 -53.74 -33.47 55.83 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.261 1.024 . . . . 73.329999999999998 112.038 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -54.97 -40.38 69.97 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.595 0.758 . . . . 74.129999999999995 111.325 175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.489 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 16.8 mt -73.74 -39.3 64.36 Favored 'General case' 0 C--N 1.349 0.554 0 O-C-N 123.545 0.528 . . . . 60.549999999999997 109.639 178.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.427 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -59.12 -32.87 70.23 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.321 0.648 . . . . 70.150000000000006 111.546 177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 84.3 mt -74.94 -55.98 5.22 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.319 0.648 . . . . 64.530000000000001 111.022 176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG2' ' HA ' ' A' ' 68' ' ' LEU . 17.8 ptpt -66.51 -34.29 77.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.17 0.433 . . . . 61.399999999999999 112.17 -171.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 76' ' ' CYS . 1.0 OUTLIER -62.2 -35.76 79.86 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.26 0.624 . . . . 72.439999999999998 110.337 173.221 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.0 t -77.79 -32.4 52.4 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.359 0.664 . . . . 74.040000000000006 111.301 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -62.77 -36.8 84.27 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 122.959 0.504 . . . . 70.310000000000002 111.489 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -87.15 -29.07 22.06 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.878 -0.601 . . . . 73.310000000000002 110.969 176.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.757 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 34.8 t -60.78 -35.51 76.61 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.988 0.915 . . . . 74.430000000000007 111.374 -177.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -25.81 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.057 0 C-N-CA 123.58 0.752 . . . . 73.409999999999997 110.146 176.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -81.88 -29.54 32.38 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.09 0.556 . . . . 55.439999999999998 110.662 178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 75.7 mt -73.21 -57.77 3.78 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.589 0.756 . . . . 74.439999999999998 110.232 178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HB3' ' CB ' ' A' ' 50' ' ' ALA . 40.0 tt0 -153.01 100.05 2.7 Favored Pre-proline 0 CA--C 1.54 0.563 0 N-CA-C 107.818 -1.178 . . . . 74.340000000000003 107.818 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -65.81 -12.15 33.95 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 123.144 2.563 . . . . 61.240000000000002 114.099 -176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.7 p -89.78 17.57 6.49 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.974 0.91 . . . . 71.530000000000001 112.266 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -72.84 99.18 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 107.895 -1.15 . . . . 74.230000000000004 107.895 169.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 20.6 mt -80.69 -44.79 21.64 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 O-C-N 120.873 -1.142 . . . . 74.310000000000002 112.144 -162.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 1.2 mptm? -76.79 -17.69 58.88 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 116.066 -0.515 . . . . 63.219999999999999 111.256 -174.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.26 -31.75 78.1 Favored Glycine 0 C--N 1.345 1.033 0 CA-C-O 119.564 -0.575 . . . . 61.439999999999998 112.464 173.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -63.65 -39.47 94.43 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.996 0.519 . . . . 75.310000000000002 110.693 170.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 14.0 m -62.75 -40.49 97.41 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.889 0.476 . . . . 75.420000000000002 111.124 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 14.3 mmt180 -77.85 -34.41 51.77 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.865 0.466 . . . . 74.010000000000005 110.731 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -63.69 -45.2 91.12 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.53 1.132 . . . . 73.219999999999999 110.256 179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.68 -37.36 82.22 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.03 -0.986 . . . . 64.019999999999996 111.082 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.44 -31.02 72.06 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.134 0.574 . . . . 71.140000000000001 111.289 173.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.7 -43.39 66.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.831 0.452 . . . . 54.25 110.309 174.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.7 mt -60.12 -35.66 75.75 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.824 0.85 . . . . 75.519999999999996 111.266 177.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.4 -38.58 66.37 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.955 0.902 . . . . 51.210000000000001 111.343 172.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.6 -16.73 59.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.886 -0.597 . . . . 51.020000000000003 110.675 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.7 mmt -94.75 5.11 52.84 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.32 0.648 . . . . 62.420000000000002 109.901 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 69.07 11.55 8.32 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 125.562 1.545 . . . . 50.43 112.113 -178.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.432 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 9.2 m-20 -87.93 48.94 1.71 Allowed 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.175 0.99 . . . . 70.25 110.775 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 17.9 m-85 -50.34 -37.84 38.98 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.115 0.966 . . . . 73.25 112.506 177.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.5 p -63.25 -40.01 96.21 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 114.783 -1.099 . . . . 70.409999999999997 111.165 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.509 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.0 mmpt? -78.23 -34.0 49.52 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.35 -0.611 . . . . 73.209999999999994 109.35 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.13 -52.05 66.49 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.456 1.102 . . . . 74.230000000000004 111.346 -179.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.6 ptp -60.41 -30.33 69.54 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 115.854 -0.612 . . . . 63.310000000000002 111.781 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -64.57 -37.35 87.26 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 123.844 0.715 . . . . 72.400000000000006 110.561 175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.512 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 58.3 t -81.76 -29.96 10.31 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.094 0 C-N-CA 123.606 0.763 . . . . 64.5 110.569 -174.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.596 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 48.0 m-85 -66.59 -40.29 88.82 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 122.645 0.378 . . . . 71.219999999999999 110.566 170.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.3 -45.33 91.58 Favored 'General case' 0 C--N 1.35 0.603 0 N-CA-C 108.479 -0.934 . . . . 73.540000000000006 108.479 175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.434 ' HA ' ' HB3' ' A' ' 112' ' ' ASP . 30.2 mmmt -63.24 -33.47 75.57 Favored 'General case' 0 C--N 1.349 0.548 0 N-CA-C 113.275 0.842 . . . . 74.409999999999997 113.275 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -45.15 89.17 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 120.959 0.409 . . . . 72.120000000000005 110.196 172.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 87.8 mt -68.56 -26.41 65.39 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-N 115.909 -0.587 . . . . 72.200000000000003 111.214 175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.434 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 23.0 t70 -71.93 -41.54 67.7 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.388 1.075 . . . . 71.519999999999996 110.586 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 87.1 mt -64.24 -48.76 74.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.928 0.767 . . . . 72.329999999999998 110.27 177.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -165.8 120.07 1.2 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.649 0.78 . . . . 74.209999999999994 109.486 173.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.467 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 42.7 m -65.67 -16.14 63.46 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.897 0.879 . . . . 70.430000000000007 112.854 -174.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -55.15 -22.19 16.08 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 122.959 0.504 . . . . 75.549999999999997 111.275 172.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 22.3 t -72.57 19.14 0.08 Allowed 'General case' 0 CA--C 1.563 1.472 0 C-N-CA 125.179 1.391 . . . . 71.329999999999998 112.555 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 115' ' ' SER . 13.7 mmmm -40.65 -18.98 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.397 0 N-CA-C 116.227 1.936 . . . . 73.150000000000006 116.227 173.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -55.58 -34.13 64.52 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 118.765 0.712 . . . . 74.450000000000003 111.481 170.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.46 -26.86 65.71 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.972 1.309 . . . . 72.409999999999997 111.867 174.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.434 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.59 -34.46 69.92 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.337 0.255 . . . . 32.009999999999998 110.385 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -65.1 -43.06 93.29 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 109.737 -0.468 . . . . 72.209999999999994 109.737 171.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.65 -28.03 72.72 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.606 -0.725 . . . . 71.040000000000006 112.745 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 8.5 t80 -61.25 -55.5 31.27 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 123.908 0.883 . . . . 73.540000000000006 109.881 174.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.48 -37.68 50.15 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 124.219 0.949 . . . . 60.109999999999999 112.067 176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.0 tpt180 -60.53 -43.1 97.5 Favored 'General case' 0 CA--C 1.562 1.412 0 C-N-CA 123.957 0.903 . . . . 61.25 111.928 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.596 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 86.7 m -82.88 -39.44 21.56 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 111.925 0.343 . . . . 71.430000000000007 111.925 -174.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.7 ptm -66.35 -45.53 79.85 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 119.687 -0.196 . . . . 53.439999999999998 110.517 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 21.0 ptm -64.6 -27.94 69.29 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.122 0.169 . . . . 61.100000000000001 111.09 -177.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.22 -44.66 95.0 Favored 'General case' 0 C--N 1.352 0.711 0 O-C-N 124.099 0.874 . . . . 63.219999999999999 112.038 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.419 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 16.3 pt20 -77.53 -23.48 50.14 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-N 116.485 -0.325 . . . . 75.010000000000005 111.285 174.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -94.45 37.92 1.11 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.797 0.439 . . . . 70.0 110.545 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 C-N-CA 123.445 0.698 . . . . 52.109999999999999 109.206 174.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.4 ttm . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 108.726 -0.842 . . . . 74.349999999999994 108.726 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -129.4 68.86 0.54 Allowed Glycine 0 C--N 1.343 0.958 0 O-C-N 123.287 0.367 . . . . 75.239999999999995 112.27 -176.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 1.6 p-80 -107.23 -1.9 21.33 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.252 0.621 . . . . 74.510000000000005 111.056 169.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -77.82 126.29 30.63 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.314 -0.625 . . . . 72.239999999999995 109.314 173.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 22.4 t60 -64.41 102.89 0.58 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.804 0.842 . . . . 72.239999999999995 109.203 176.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -86.76 118.91 26.47 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.456 0.702 . . . . 74.140000000000001 110.001 -177.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 57.6 t-80 -167.23 -50.59 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.527 1.131 . . . . 74.230000000000004 108.462 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -79.63 73.26 6.33 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.457 -0.792 . . . . 74.209999999999994 109.425 178.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.1 t -179.15 159.62 0.98 Allowed 'General case' 0 C--O 1.242 0.683 0 C-N-CA 125.708 1.603 . . . . 72.120000000000005 107.75 -178.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.4 p-80 -63.46 96.74 0.12 Allowed 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 121.294 0.569 . . . . 74.140000000000001 109.607 174.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.0 mtp -70.05 -30.45 67.71 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.685 -0.689 . . . . 71.340000000000003 111.27 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -132.23 152.82 80.8 Favored Pre-proline 0 N--CA 1.479 1.025 0 C-N-CA 123.754 0.821 . . . . 63.43 110.133 178.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.14 -51.83 6.95 Favored 'Trans proline' 0 C--N 1.389 2.69 0 C-N-CA 123.249 2.633 . . . . 64.209999999999994 112.734 -178.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.579 ' HB3' HD23 ' A' ' 17' ' ' LEU . 15.2 t70 -161.63 111.02 1.56 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.311 0.577 . . . . 75.310000000000002 110.203 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.09 -33.15 71.69 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.36 1.064 . . . . 74.150000000000006 110.938 -178.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.48 -29.91 70.27 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.61 -0.723 . . . . 75.129999999999995 112.1 179.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -78.61 -26.17 45.3 Favored 'General case' 0 C--N 1.35 0.628 0 N-CA-C 109.42 -0.585 . . . . 75.5 109.42 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.6 mmt -77.51 -37.46 50.99 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.6 0.714 . . . . 74.420000000000002 110.216 -174.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -77.47 -22.94 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.225 0 CA-C-N 114.582 -1.19 . . . . 72.209999999999994 111.193 -177.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -81.17 -26.68 35.84 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 121.942 -0.474 . . . . 74.140000000000001 110.964 173.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -64.49 -45.48 87.12 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.769 0.428 . . . . 73.140000000000001 111.193 178.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -66.54 -32.92 74.58 Favored 'General case' 0 N--CA 1.478 0.929 0 O-C-N 123.334 0.396 . . . . 74.450000000000003 111.358 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.03 -52.89 44.42 Favored Glycine 0 C--N 1.349 1.262 0 O-C-N 123.411 0.444 . . . . 60.140000000000001 112.492 175.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -54.96 -43.92 73.89 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.619 1.168 . . . . 64.439999999999998 111.611 174.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 5.6 tt0 -62.79 -55.27 27.99 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.282 -0.872 . . . . 71.049999999999997 110.475 -179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 92.2 m -58.0 -43.97 86.95 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 123.917 0.761 . . . . 75.109999999999999 111.918 -171.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -51.1 -50.12 59.4 Favored 'General case' 0 N--CA 1.484 1.23 0 O-C-N 123.882 0.739 . . . . 74.430000000000007 110.161 174.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -66.73 -25.47 66.53 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.094 -1.412 . . . . 74.239999999999995 111.651 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 1.0 OUTLIER -80.82 -5.89 57.85 Favored 'General case' 0 N--CA 1.483 1.21 0 O-C-N 122.163 -0.335 . . . . 70.400000000000006 110.114 178.909 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.21 -0.25 33.27 Favored Glycine 0 C--N 1.354 1.532 0 CA-C-O 119.952 -0.36 . . . . 71.519999999999996 112.795 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 4.3 m-20 -88.52 69.44 8.9 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.716 0.806 . . . . 71.019999999999996 109.588 178.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.469 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.1 m-85 -64.27 -53.61 45.41 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 118.714 -0.66 . . . . 64.129999999999995 111.451 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 23.6 Cg_exo -64.19 -47.61 6.01 Favored 'Trans proline' 0 C--N 1.39 2.749 0 C-N-CA 121.752 1.634 . . . . 74.310000000000002 112.503 177.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -62.64 -28.03 69.63 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.946 0.499 . . . . 63.210000000000001 111.508 -176.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.44 -36.4 73.59 Favored 'General case' 0 C--N 1.352 0.705 0 O-C-N 123.621 0.576 . . . . 42.100000000000001 111.214 175.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 51.5 mtm -63.1 -41.24 99.33 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.627 0.58 . . . . 73.219999999999999 110.051 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -70.08 -34.75 73.56 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 124.074 0.859 . . . . 74.239999999999995 110.294 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -72.03 -21.1 61.59 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.449 -0.796 . . . . 43.109999999999999 111.557 175.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -83.34 -32.02 26.49 Favored 'General case' 0 C--O 1.213 -0.865 0 C-N-CA 122.701 0.401 . . . . 71.049999999999997 110.039 168.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.402 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 84.9 m -66.23 -44.02 84.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.013 0.525 . . . . 74.109999999999999 110.928 -178.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -67.77 -29.23 68.38 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 122.977 0.511 . . . . 73.099999999999994 110.623 175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.33 -39.43 81.95 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 123.117 0.567 . . . . 62.43 110.949 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.94 -33.13 45.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 110.76 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.4 mmtp -71.01 -22.87 62.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.008 0.523 . . . . 53.140000000000001 111.675 -178.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -94.96 -32.26 13.26 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.654 0.782 . . . . 73.049999999999997 111.335 176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -131.23 73.85 79.88 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 123.134 0.574 . . . . 75.030000000000001 111.84 178.341 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.538 ' HG2' ' HD3' ' A' ' 48' ' ' LYS . 83.1 Cg_endo -74.59 -2.41 12.39 Favored 'Trans proline' 0 C--N 1.385 2.48 0 C-N-CA 122.795 2.33 . . . . 65.120000000000005 113.518 -176.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.538 ' HD3' ' HG2' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -100.95 -24.2 14.39 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.149 0.58 . . . . 63.420000000000002 110.334 176.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 18.8 t70 -72.36 88.38 1.18 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.87 0.868 . . . . 72.5 109.385 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.793 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -77.48 -27.54 52.0 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.291 0.849 . . . . 73.030000000000001 113.291 -164.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.79 -23.14 67.15 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 118.557 0.617 . . . . 63.409999999999997 110.256 175.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.62 -36.35 68.04 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.898 0.879 . . . . 44.119999999999997 109.69 175.565 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 62.9 m-85 -62.87 -47.14 84.63 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.283 0.633 . . . . 71.019999999999996 110.409 171.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.3 t -71.41 -20.02 62.18 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.527 0.731 . . . . 63.149999999999999 111.622 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -65.97 -37.8 86.93 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.426 0.69 . . . . 70.219999999999999 110.691 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 27.1 ptt-85 -70.25 -29.31 66.07 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 110.105 -0.332 . . . . 74.239999999999995 110.105 178.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -67.06 -40.67 87.11 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.435 0.694 . . . . 75.519999999999996 110.291 173.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.01 -23.83 67.33 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 115.029 -0.987 . . . . 52.109999999999999 111.237 175.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.4 t -81.76 -37.56 27.02 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.328 0.651 . . . . 53.149999999999999 111.213 173.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -56.91 -31.66 65.14 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.959 0.504 . . . . 53.109999999999999 112.336 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 82.8 p -56.66 -39.17 73.26 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.713 0.405 . . . . 53.219999999999999 110.843 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -68.42 -31.7 71.22 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.537 0.735 . . . . 61.340000000000003 110.35 -176.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.2 mt -86.15 4.86 36.58 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 114.907 -1.042 . . . . 73.010000000000005 111.181 178.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 67.21 12.31 8.87 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 124.52 1.128 . . . . 72.219999999999999 111.593 -177.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -89.09 51.77 2.23 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.729 1.212 . . . . 72.230000000000004 110.481 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.437 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 71.2 m-85 -58.8 -31.6 68.57 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.031 0.933 . . . . 65.409999999999997 112.15 -178.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -55.85 -41.3 74.12 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.298 0.639 . . . . 74.430000000000007 110.211 174.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.9 mt -79.65 -32.86 41.64 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.592 -0.731 . . . . 74.549999999999997 109.209 -179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.5 -27.61 69.39 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.457 0.703 . . . . 71.340000000000003 111.784 178.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 95.4 mt -70.91 -61.63 1.69 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.6 0.36 . . . . 62.240000000000002 111.104 173.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 11.6 ptmm? -69.84 -37.47 76.19 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.347 0.869 . . . . 72.150000000000006 113.347 -170.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -74.69 -20.42 59.86 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.315 0.646 . . . . 71.319999999999993 111.371 179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.465 ' SG ' ' HE2' ' A' ' 83' ' ' PHE . 53.9 t -81.35 -45.33 16.3 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 122.788 0.435 . . . . 75.030000000000001 111.265 172.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.52 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.9 pt-20 -74.32 -22.04 59.44 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.757 0.651 . . . . 71.040000000000006 112.757 -173.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.32 -31.14 72.21 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-N 118.345 0.521 . . . . 50.109999999999999 110.549 173.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.599 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 35.2 t -59.92 -28.76 67.88 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.026 0.93 . . . . 73.430000000000007 112.076 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.446 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -57.32 -30.08 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 123.265 0.626 . . . . 74.140000000000001 111.19 177.333 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -74.06 -38.15 64.03 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.48 0.712 . . . . 54.109999999999999 111.547 -174.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 68.6 mt -85.81 -46.6 10.5 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 122.879 0.472 . . . . 74.150000000000006 110.355 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.793 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 45.1 tt0 -151.92 103.82 2.83 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.476 1.11 . . . . 72.150000000000006 109.177 -175.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -80.37 -0.09 10.4 Favored 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.017 2.478 . . . . 73.519999999999996 113.714 -176.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.3 p -95.76 15.67 19.55 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.104 0.562 . . . . 73.049999999999997 111.738 -176.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 19.9 p90 -72.0 94.41 1.48 Allowed 'General case' 0 CA--C 1.557 1.215 0 CA-C-O 122.955 1.359 . . . . 74.040000000000006 109.536 176.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.476 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 55.0 mt -72.64 -44.92 59.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-N 115.239 -0.891 . . . . 65.140000000000001 110.937 -171.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.497 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.2 mmpt? -68.15 -29.7 68.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 114.656 -1.156 . . . . 55.130000000000003 111.886 -174.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.94 83.59 Favored Glycine 0 C--N 1.345 1.054 0 O-C-N 123.782 0.676 . . . . 64.140000000000001 112.292 175.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -61.93 -33.83 74.98 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.898 0.479 . . . . 64.519999999999996 112.129 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.468 HG23 ' HB2' ' A' ' 120' ' ' ALA . 7.0 m -69.12 -34.21 74.69 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.39 0.431 . . . . 71.310000000000002 110.755 -179.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.1 -30.01 28.3 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.583 0.753 . . . . 75.120000000000005 111.306 176.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.479 ' NZ ' ' HB3' ' A' ' 74' ' ' GLU . 24.1 tptm -67.25 -51.21 55.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.865 0.866 . . . . 71.219999999999999 110.273 -178.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.595 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.49 -33.26 74.74 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 115.1 -0.954 . . . . 73.319999999999993 110.888 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.72 95.01 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.121 0.568 . . . . 65.510000000000005 110.573 173.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.427 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -66.14 -46.53 77.16 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.868 -0.605 . . . . 73.430000000000007 110.284 176.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.1 mt -57.64 -36.85 72.4 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.669 0.787 . . . . 54.119999999999997 111.607 178.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.5 tm-20 -62.26 -35.4 78.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.815 0.846 . . . . 74.239999999999995 109.812 175.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.55 -3.41 50.12 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 116.04 -0.527 . . . . 75.299999999999997 110.999 178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 21.8 mmt -105.28 5.02 31.64 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.727 0.811 . . . . 73.200000000000003 110.867 177.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm 70.9 8.24 6.47 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.958 1.303 . . . . 65.540000000000006 112.16 -172.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -90.09 48.08 1.53 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.597 0.759 . . . . 74.230000000000004 111.046 -176.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -53.55 -35.72 61.05 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.071 0.948 . . . . 74.310000000000002 112.332 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 38.0 p -59.9 -45.22 93.24 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 124.29 0.994 . . . . 70.120000000000005 110.722 175.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.418 ' O ' HG23 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -71.67 -40.38 69.65 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.218 0.607 . . . . 52.450000000000003 110.557 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.43 76.06 Favored 'General case' 0 C--N 1.341 0.231 0 O-C-N 124.332 1.02 . . . . 63.119999999999997 110.899 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.406 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 18.4 ptp -64.96 -24.6 67.57 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 123.861 0.726 . . . . 71.329999999999998 112.007 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 50.7 m-20 -68.43 -41.27 80.59 Favored 'General case' 0 C--N 1.354 0.782 0 N-CA-C 109.629 -0.508 . . . . 75.140000000000001 109.629 172.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.595 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 60.5 t -77.49 -28.25 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.531 0.733 . . . . 61.340000000000003 109.981 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.875 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 29.0 m-85 -68.62 -40.19 80.47 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.784 -0.643 . . . . 73.019999999999996 109.998 171.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.93 -44.1 97.47 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.647 -0.871 . . . . 70.540000000000006 108.647 175.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 33.0 mmmt -63.67 -37.11 86.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.692 0.797 . . . . 41.130000000000003 111.394 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -48.18 79.94 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 122.877 0.471 . . . . 74.140000000000001 109.908 176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.3 mt -65.23 -28.71 69.55 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.649 0.78 . . . . 71.099999999999994 111.672 176.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.7 -34.32 69.52 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.379 1.072 . . . . 75.420000000000002 110.053 179.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 71.8 mt -75.55 -38.77 59.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 122.757 0.423 . . . . 75.109999999999999 110.117 175.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -166.47 127.32 1.69 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 122.977 0.511 . . . . 74.310000000000002 110.391 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 58.0 p -62.63 -27.58 69.31 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.462 0.705 . . . . 61.43 111.15 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 11.4 m -57.9 -13.4 4.37 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 123.391 0.676 . . . . 75.420000000000002 111.771 177.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.476 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 41.7 m -68.88 17.26 0.04 OUTLIER 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.498 1.119 . . . . 62.299999999999997 112.965 169.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -38.05 -35.85 0.18 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 114.215 1.191 . . . . 54.32 114.215 168.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.33 -40.71 71.51 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.25 0.548 . . . . 74.349999999999994 111.248 173.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -73.85 -26.26 60.48 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.368 1.067 . . . . 71.25 110.728 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.554 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -71.43 -35.82 71.08 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 109.603 -0.517 . . . . 61.399999999999999 109.603 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.85 -33.18 75.26 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 122.761 0.425 . . . . 73.450000000000003 109.982 173.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.6 -30.91 75.27 Favored Glycine 0 C--N 1.349 1.283 0 CA-C-N 115.555 -0.748 . . . . 54.0 112.173 172.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.465 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 15.8 t80 -62.4 -55.5 27.25 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 122.967 0.507 . . . . 71.219999999999999 110.099 172.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.1 -36.26 50.37 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 123.58 0.55 . . . . 72.120000000000005 111.445 176.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.78 -49.61 77.05 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.726 0.642 . . . . 74.450000000000003 111.037 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.875 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 93.2 m -68.94 -45.68 70.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 122.557 0.343 . . . . 71.239999999999995 111.627 -171.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.0 ptm -63.15 -42.97 99.55 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 116.091 -0.504 . . . . 61.539999999999999 111.022 179.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.4 ptm -75.94 -22.94 55.46 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 122.267 -0.27 . . . . 72.430000000000007 111.376 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -68.02 -45.22 74.62 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.378 0.671 . . . . 72.439999999999998 110.953 -177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -71.47 -28.43 63.94 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 116.43 -0.35 . . . . 60.439999999999998 110.795 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.7 m-30 -100.31 36.87 1.78 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.821 0.449 . . . . 75.549999999999997 110.768 -179.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 109.287 -0.635 . . . . 71.430000000000007 109.287 173.749 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.0 mmt . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.593 -0.521 . . . . 60.420000000000002 109.593 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.47 99.31 0.72 Allowed Glycine 0 C--N 1.348 1.2 0 O-C-N 123.968 0.792 . . . . 71.349999999999994 111.638 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -120.81 18.76 11.84 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.484 0.713 . . . . 53.420000000000002 110.767 176.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -78.06 -7.2 56.62 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.302 0.641 . . . . 64.430000000000007 110.295 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 t60 -57.1 114.65 2.23 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 124.014 0.926 . . . . 75.25 109.925 174.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.1 m-70 -66.09 118.07 9.32 Favored 'General case' 0 C--O 1.24 0.602 0 O-C-N 124.131 0.894 . . . . 74.219999999999999 110.203 -176.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -74.92 77.1 2.16 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.337 1.055 . . . . 63.200000000000003 110.16 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -172.94 164.77 5.05 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.84 1.256 . . . . 72.329999999999998 109.828 177.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.0 p -51.44 92.33 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 125.324 1.45 . . . . 54.140000000000001 114.128 -169.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -140.62 90.34 2.34 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 107.156 -1.424 . . . . 75.420000000000002 107.156 168.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 50.9 -76.02 0.01 OUTLIER 'General case' 0 C--N 1.359 0.987 0 C-N-CA 126.634 1.974 . . . . 71.239999999999995 111.492 -167.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -109.95 100.52 43.62 Favored Pre-proline 0 N--CA 1.473 0.685 0 N-CA-C 107.792 -1.188 . . . . 71.319999999999993 107.792 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.5 -39.03 75.54 Favored 'Trans proline' 0 C--N 1.381 2.243 0 C-N-CA 123.501 2.801 . . . . 75.519999999999996 113.185 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -177.19 112.81 0.09 Allowed 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.564 1.145 . . . . 74.340000000000003 107.993 177.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.502 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -60.97 -33.14 72.74 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.424 0.631 . . . . 62.32 109.947 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -62.92 -25.13 68.18 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 114.708 -1.133 . . . . 73.040000000000006 112.449 176.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.559 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -76.47 -25.78 54.69 Favored 'General case' 0 C--N 1.351 0.636 0 N-CA-C 110.07 -0.345 . . . . 42.229999999999997 110.07 178.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.3 mmt -70.54 -42.28 71.42 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 121.436 0.636 . . . . 74.239999999999995 109.6 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.2 p -77.84 -33.04 18.25 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 115.176 -0.92 . . . . 72.510000000000005 111.725 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.596 ' HB2' HD11 ' A' ' 52' ' ' LEU . 15.9 ptpt -69.74 -20.91 63.5 Favored 'General case' 0 N--CA 1.483 1.204 0 O-C-N 121.677 -0.639 . . . . 51.219999999999999 111.017 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.73 -49.46 58.63 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.514 0.726 . . . . 73.019999999999996 111.228 175.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.45 ' HD3' ' N ' ' A' ' 23' ' ' GLY . 0.0 OUTLIER -68.05 -33.49 74.67 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.043 0.137 . . . . 73.420000000000002 110.842 179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.45 ' N ' ' HD3' ' A' ' 22' ' ' LYS . . . -66.41 -44.54 90.15 Favored Glycine 0 C--N 1.352 1.459 0 N-CA-C 111.894 -0.483 . . . . 71.209999999999994 111.894 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.425 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 11.3 t30 -59.15 -42.45 90.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.588 1.155 . . . . 54.310000000000002 111.441 178.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 9.5 pt-20 -73.59 -37.88 65.32 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.564 -0.731 . . . . 62.310000000000002 110.328 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 97.7 m -52.67 -43.0 65.26 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.417 0.553 . . . . 61.439999999999998 111.731 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.18 -43.14 96.12 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.447 -0.797 . . . . 55.299999999999997 110.481 176.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -71.3 -11.87 61.14 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.303 0.641 . . . . 70.239999999999995 111.555 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 24.3 mmmt -83.5 -6.32 59.42 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 109.908 -0.404 . . . . 75.329999999999998 109.908 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.09 -7.54 35.37 Favored Glycine 0 C--N 1.359 1.85 0 CA-C-O 119.91 -0.383 . . . . 73.540000000000006 112.472 178.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 4.0 m-20 -71.67 138.93 48.98 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.408 0.683 . . . . 73.310000000000002 109.924 177.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.525 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 7.9 m-85 -118.59 -59.9 0.03 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 CA-C-O 118.493 -0.765 . . . . 62.43 109.482 173.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.525 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 24.1 Cg_exo -65.66 -50.42 1.81 Allowed 'Trans proline' 0 C--N 1.392 2.865 0 CA-C-N 121.391 1.533 . . . . 70.420000000000002 111.438 174.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.408 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 28.9 mm-40 -57.43 -43.07 83.57 Favored 'General case' 0 C--N 1.36 1.044 0 O-C-N 123.271 0.357 . . . . 75.010000000000005 110.5 178.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.34 72.35 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 115.839 -0.619 . . . . 74.430000000000007 111.296 174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.41 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 51.1 ttp -68.29 -32.95 73.46 Favored 'General case' 0 C--N 1.353 0.742 0 C-N-CA 123.492 0.717 . . . . 53.200000000000003 109.589 -176.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -76.06 -33.96 59.58 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.012 0.925 . . . . 72.519999999999996 110.677 177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -71.3 -21.23 62.1 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.602 -0.726 . . . . 64.25 110.772 172.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.425 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 35.5 m-85 -84.46 -30.72 25.02 Favored 'General case' 0 C--O 1.212 -0.921 0 C-N-CA 123.084 0.554 . . . . 64.040000000000006 111.073 168.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.3 m -67.32 -39.15 85.85 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.805 0.442 . . . . 71.430000000000007 110.807 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -68.42 -27.91 66.61 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 110.174 -0.306 . . . . 72.450000000000003 110.174 173.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.28 -40.13 77.95 Favored 'General case' 0 C--N 1.352 0.711 0 C-N-CA 122.803 0.441 . . . . 74.25 110.444 172.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -58.08 -33.56 46.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 124.54 1.136 . . . . 74.049999999999997 111.018 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -59.92 -44.35 94.37 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.13 0.572 . . . . 61.32 110.605 177.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.402 ' HB3' ' HA ' ' A' ' 16' ' ' ALA . 34.4 mmt180 -75.42 -36.43 60.79 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.133 -0.94 . . . . 73.329999999999998 111.423 179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.431 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 0.4 OUTLIER -122.55 83.72 47.91 Favored Pre-proline 0 N--CA 1.481 1.082 0 N-CA-C 112.834 0.679 . . . . 71.420000000000002 112.834 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.96 7.8 3.07 Favored 'Trans proline' 0 C--N 1.376 2.026 0 C-N-CA 122.474 2.116 . . . . 51.420000000000002 112.274 168.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.11 -0.03 10.62 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.211 1.404 . . . . 72.450000000000003 112.108 -172.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -113.65 85.48 2.21 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 122.731 0.412 . . . . 54.530000000000001 110.356 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.49 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . . . -58.35 -23.55 57.12 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.08 0.952 . . . . 73.109999999999999 113.426 175.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -68.27 -24.62 64.9 Favored 'General case' 0 CA--C 1.557 1.25 0 C-N-CA 122.4 0.28 . . . . 73.310000000000002 111.268 175.546 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.596 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.2 mm? -77.76 -40.44 40.9 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.718 0.807 . . . . 65.239999999999995 110.628 173.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -62.38 -32.09 72.86 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-N 115.582 -0.735 . . . . 75.219999999999999 110.772 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 28.5 t -71.09 -23.85 62.19 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.458 1.103 . . . . 64.140000000000001 112.108 177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.43 HD22 HD13 ' A' ' 52' ' ' LEU . 87.1 m-20 -71.86 -35.42 69.81 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.141 0.495 . . . . 71.409999999999997 109.805 175.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -65.93 -45.9 80.16 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 115.15 -0.932 . . . . 72.340000000000003 109.653 170.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.77 -34.65 78.84 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.919 0.888 . . . . 72.400000000000006 111.72 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.65 -32.49 72.36 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.289 -0.869 . . . . 74.340000000000003 110.017 178.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.1 t -75.08 -43.48 52.88 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 122.751 0.421 . . . . 74.120000000000005 110.439 174.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.41 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 10.9 m-85 -53.86 -37.98 64.21 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 124.318 1.047 . . . . 71.439999999999998 112.192 -174.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.3 p -57.77 -43.81 85.77 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 122.896 0.478 . . . . 61.450000000000003 111.507 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -65.67 -36.19 82.96 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 109.487 -0.56 . . . . 70.430000000000007 109.487 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.4 mt -81.15 3.16 24.54 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.079 0.952 . . . . 71.329999999999998 111.361 -178.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 69.97 5.5 5.3 Favored 'General case' 0 C--N 1.372 1.562 0 C-N-CA 124.495 1.118 . . . . 71.340000000000003 112.256 -178.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -85.26 42.57 0.95 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.092 1.357 . . . . 70.530000000000001 111.171 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.424 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 94.3 m-85 -53.13 -33.35 51.97 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.056 0.942 . . . . 64.540000000000006 110.961 177.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -55.77 -43.3 76.6 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.911 0.884 . . . . 65.230000000000004 111.48 175.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 37.8 mt -71.81 -39.58 69.75 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 109.209 -0.663 . . . . 62.100000000000001 109.209 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.27 -31.29 71.11 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.101 0.876 . . . . 64.400000000000006 111.649 176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.439 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 84.2 mt -73.95 -65.4 0.84 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.314 0.646 . . . . 74.439999999999998 110.833 174.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -63.62 -35.68 81.33 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.782 0.833 . . . . 72.200000000000003 112.613 -168.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -66.56 -41.51 88.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.816 -0.439 . . . . 64.409999999999997 109.816 177.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.04 -30.51 66.71 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.914 0.485 . . . . 71.010000000000005 111.499 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 47.9 mm-40 -60.35 -41.33 93.43 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.825 0.45 . . . . 72.25 111.253 178.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.89 -33.59 19.71 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 122.725 0.41 . . . . 75.099999999999994 111.623 179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.495 ' SG ' HD12 ' A' ' 79' ' ' LEU . 5.2 t -71.64 -22.68 61.65 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.071 0.548 . . . . 75.209999999999994 112.369 -170.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -24.56 31.87 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.213 0 C-N-CA 123.092 0.557 . . . . 73.319999999999993 110.343 172.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.0 mm-40 -78.16 -24.09 47.42 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.469 0.308 . . . . 71.329999999999998 110.837 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.495 HD12 ' SG ' ' A' ' 76' ' ' CYS . 82.7 mt -78.84 -43.04 26.04 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.756 0.822 . . . . 75.040000000000006 110.341 175.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.43 ' HG3' ' HB3' ' A' ' 83' ' ' PHE . 6.6 tp10 -150.97 104.53 3.01 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.221 -1.4 . . . . 72.510000000000005 107.221 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -80.83 -29.67 2.07 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.477 2.118 . . . . 62.409999999999997 114.707 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 68.8 p -94.31 16.23 15.52 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.424 0.528 . . . . 73.25 112.424 -170.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 2.0 p90 -70.6 120.24 15.94 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 109.461 -0.57 . . . . 75.329999999999998 109.461 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 38.7 mt -82.15 -45.5 19.84 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 C-N-CA 122.984 0.514 . . . . 73.209999999999994 109.826 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -67.82 92.29 0.35 Allowed 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 107.828 -1.175 . . . . 72.310000000000002 107.828 172.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.417 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . 162.14 -46.93 0.35 Allowed Glycine 0 C--N 1.345 1.039 0 O-C-N 123.715 0.635 . . . . 70.329999999999998 112.639 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.87 -39.51 94.65 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.03 0.532 . . . . 64.019999999999996 111.898 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 17.2 m -60.75 -37.22 81.09 Favored 'General case' 0 CA--C 1.56 1.352 0 C-N-CA 122.938 0.495 . . . . 72.040000000000006 111.109 176.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -79.83 -34.71 39.22 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.853 0.861 . . . . 74.129999999999995 111.189 -178.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -67.62 -43.11 81.21 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.387 1.075 . . . . 72.319999999999993 109.864 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.558 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.47 -32.59 68.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 114.737 -1.119 . . . . 64.310000000000002 111.02 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.06 -37.22 85.29 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.311 0.644 . . . . 74.140000000000001 110.952 174.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.9 -46.66 64.95 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.618 -0.719 . . . . 74.239999999999995 110.418 176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.71 -39.67 77.75 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.655 0.782 . . . . 73.319999999999993 111.03 175.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -61.84 -31.17 71.4 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.69 0.796 . . . . 64.310000000000002 110.635 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.33 -14.7 58.15 Favored 'General case' 0 C--N 1.355 0.842 0 C-N-CA 122.982 0.513 . . . . 55.530000000000001 110.491 178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.5 mmt -100.43 9.28 42.84 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.845 0.858 . . . . 62.539999999999999 110.214 177.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm 68.89 10.33 7.86 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.103 1.361 . . . . 74.150000000000006 112.129 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -84.68 50.97 2.01 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.181 0.992 . . . . 62.329999999999998 110.913 -178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -53.8 -36.9 62.97 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.629 0.772 . . . . 73.219999999999999 112.183 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.2 p -61.35 -31.84 71.72 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 124.403 1.081 . . . . 75.120000000000005 112.036 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 106' ' ' VAL . 52.9 mmtt -87.42 -44.88 11.01 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.979 0.511 . . . . 75.219999999999999 109.649 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.22 -47.2 81.92 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 114.38 -1.282 . . . . 63.200000000000003 111.403 -174.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.488 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 18.6 ptp -54.66 -38.29 66.75 Favored 'General case' 0 N--CA 1.474 0.748 0 O-C-N 124.175 0.922 . . . . 64.450000000000003 112.411 -178.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 5.3 m-20 -71.33 -32.61 68.78 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.015 0.526 . . . . 73.150000000000006 110.773 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 44.0 t -79.9 -34.19 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 N-CA-C 109.867 -0.42 . . . . 63.219999999999999 109.867 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -60.09 -45.14 93.94 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.616 0.766 . . . . 74.420000000000002 109.54 167.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -38.33 90.65 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.764 -1.107 . . . . 64.299999999999997 109.68 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 28.9 mmmt -69.29 -33.93 73.95 Favored 'General case' 0 C--N 1.357 0.894 0 C-N-CA 122.979 0.512 . . . . 64.230000000000004 111.544 178.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.808 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -60.94 -47.37 86.73 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 123.429 0.455 . . . . 74.129999999999995 110.251 172.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 56.3 mt -64.45 -34.15 77.53 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 115.402 -0.817 . . . . 74.230000000000004 111.354 175.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -66.52 -35.66 80.79 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.894 1.278 . . . . 71.540000000000006 110.541 -176.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.4 mt -67.73 -48.68 65.78 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 116.056 -0.52 . . . . 73.319999999999993 110.58 177.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -166.1 146.94 6.58 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.001 0.429 . . . . 73.329999999999998 111.173 170.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 63.0 p -57.02 -28.53 62.57 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.369 1.468 . . . . 62.520000000000003 112.577 -177.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 43.6 p -57.49 -13.61 3.9 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.927 0.891 . . . . 51.039999999999999 112.487 178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.808 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 5.4 t -83.88 18.71 1.92 Allowed 'General case' 0 CA--C 1.552 1.048 0 CA-C-O 118.649 -0.691 . . . . 64.540000000000006 112.702 174.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 31.2 mmmt -39.7 -27.42 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.264 1.579 . . . . 74.230000000000004 115.264 176.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.17 -39.51 56.54 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.602 0.761 . . . . 71.329999999999998 112.221 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.11 63.1 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.315 1.046 . . . . 73.450000000000003 112.407 177.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.93 -40.73 68.54 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 120.987 0.422 . . . . 73.209999999999994 110.079 178.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.4 -45.01 95.11 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.289 -0.869 . . . . 73.099999999999994 110.19 172.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.87 -35.67 92.18 Favored Glycine 0 C--N 1.349 1.291 0 CA-C-N 115.479 -0.782 . . . . 52.049999999999997 113.236 177.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -65.32 -53.09 48.9 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.748 0.819 . . . . 72.439999999999998 111.404 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -57.51 -25.34 59.68 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.848 0.859 . . . . 73.510000000000005 112.429 178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -81.21 -35.92 30.71 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.326 0.65 . . . . 72.450000000000003 110.695 173.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 49.5 t -74.59 -36.78 63.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.739 0.816 . . . . 75.329999999999998 111.159 -172.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 19.1 ptm -68.53 -46.5 69.37 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 115.878 -0.601 . . . . 73.140000000000001 110.91 178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 23.2 ptm -72.5 -18.94 61.62 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.283 0.233 . . . . 75.430000000000007 111.113 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.2 -44.58 97.05 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.172 0.989 . . . . 73.420000000000002 112.047 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -74.84 -12.3 60.35 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 116.479 -0.328 . . . . 73.349999999999994 111.677 176.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -102.01 37.36 1.87 Allowed 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.993 0.517 . . . . 63.43 110.166 -178.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 15.0 m120 . . . . . 0 C--O 1.249 1.03 0 N-CA-C 108.696 -0.853 . . . . 64.439999999999998 108.696 179.906 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.22 -0.659 . . . . 55.130000000000003 109.22 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.91 25.58 5.24 Favored Glycine 0 C--N 1.349 1.253 0 CA-C-O 119.93 -0.372 . . . . 61.329999999999998 113.033 -176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.7 m170 -74.88 82.01 2.16 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.002 0.521 . . . . 73.019999999999996 110.16 177.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 20.4 m80 -153.05 152.59 31.53 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.421 1.488 . . . . 74.340000000000003 107.926 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -66.3 140.85 58.14 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 109.51 -0.552 . . . . 75.109999999999999 109.51 175.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -66.65 136.49 55.63 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 123.301 0.375 . . . . 62.219999999999999 110.16 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -80.54 113.66 18.89 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.642 0.777 . . . . 71.299999999999997 109.819 -174.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -82.22 61.9 5.67 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.949 0.881 . . . . 71.430000000000007 110.422 177.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -81.14 19.67 0.89 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.193 0.997 . . . . 74.409999999999997 112.909 -172.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -83.52 104.98 14.08 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 107.962 -1.125 . . . . 75.549999999999997 107.962 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.0 mmt -65.6 -35.34 80.54 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.193 0.597 . . . . 64.430000000000007 111.894 -173.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -96.55 112.3 59.7 Favored Pre-proline 0 CA--C 1.547 0.836 0 N-CA-C 108.485 -0.932 . . . . 71.530000000000001 108.485 168.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -66.91 -37.93 18.35 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.503 2.135 . . . . 64.540000000000006 111.336 173.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -161.35 113.15 1.8 Allowed 'General case' 0 C--N 1.349 0.585 0 CA-C-N 115.52 -0.764 . . . . 63.420000000000002 109.426 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.511 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.66 -34.4 75.64 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.372 0.606 . . . . 73.150000000000006 110.072 179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.21 -23.57 67.49 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 115.007 -0.997 . . . . 61.25 112.074 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.532 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.19 -29.82 60.47 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 109.047 -0.723 . . . . 61.229999999999997 109.047 177.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 17.3 mmt -72.16 -37.36 69.4 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 121.258 0.551 . . . . 62.020000000000003 109.642 -175.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.517 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.9 p -85.23 -21.35 7.89 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.242 0 CA-C-N 115.163 -0.926 . . . . 73.239999999999995 111.827 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.532 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.5 ptpt -80.47 -26.96 37.98 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.272 -0.893 . . . . 75.400000000000006 110.781 175.538 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -63.75 -39.76 95.06 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.13 0.972 . . . . 65.209999999999994 111.671 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -66.02 -39.01 89.87 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.518 0.327 . . . . 72.329999999999998 110.291 174.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -62.02 -31.54 79.03 Favored Glycine 0 C--N 1.352 1.441 0 CA-C-N 116.643 -0.253 . . . . 74.310000000000002 113.378 176.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 81.9 m-20 -70.19 -43.5 70.62 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.764 0.826 . . . . 71.5 110.986 178.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 11.6 pt-20 -72.94 -44.72 60.84 Favored 'General case' 0 C--N 1.354 0.789 0 CA-C-O 118.515 -0.755 . . . . 64.010000000000005 110.625 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 89.8 m -47.58 -49.95 25.29 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.376 1.047 . . . . 60.310000000000002 112.511 -171.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -50.47 -52.44 38.11 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.151 1.381 . . . . 71.140000000000001 111.008 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -68.06 -20.23 64.95 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 113.699 -1.591 . . . . 53.119999999999997 111.835 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.58 -12.37 57.76 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 110.315 -0.254 . . . . 75.549999999999997 110.315 179.005 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 115.44 -1.7 22.08 Favored Glycine 0 C--N 1.353 1.507 0 O-C-N 123.203 0.314 . . . . 73.530000000000001 112.461 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.618 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 3.2 m-20 -93.45 67.75 4.05 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.872 -0.788 . . . . 44.210000000000001 108.872 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 3.0 m-85 -64.16 -51.49 61.91 Favored Pre-proline 0 CA--C 1.568 1.66 0 N-CA-C 113.019 0.748 . . . . 75.030000000000001 113.019 -174.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.4 ' HD3' ' HB2' ' A' ' 32' ' ' TYR . 10.3 Cg_exo -70.86 -45.73 0.93 Allowed 'Trans proline' 0 C--N 1.388 2.625 0 C-N-CA 121.837 1.691 . . . . 53.140000000000001 111.523 176.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.1 OUTLIER -59.16 -31.0 68.59 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.779 0.832 . . . . 74.519999999999996 111.308 -177.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.4 -39.37 90.49 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.192 0.597 . . . . 63.140000000000001 111.367 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 54.4 ttp -68.88 -29.69 68.04 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.943 0.777 . . . . 73.519999999999996 109.598 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.462 ' HD2' HE21 ' A' ' 34' ' ' GLN . 66.0 mttm -75.37 -33.45 61.05 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.604 0.762 . . . . 74.349999999999994 110.478 175.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -72.94 -21.0 60.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.185 0.594 . . . . 75.129999999999995 110.661 172.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 33.8 m-85 -76.35 -40.8 50.26 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 109.816 -0.439 . . . . 74.450000000000003 109.816 165.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 70.9 m -58.3 -36.34 73.2 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.182 0.593 . . . . 73.310000000000002 111.917 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -75.67 -28.55 58.75 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.314 -0.403 . . . . 73.230000000000004 110.454 175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.92 -38.02 82.4 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.908 0.483 . . . . 71.230000000000004 110.532 174.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -54.74 -34.91 31.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 C-N-CA 124.534 1.133 . . . . 71.099999999999994 110.596 176.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -61.16 -37.6 83.47 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.401 0.68 . . . . 74.329999999999998 111.021 177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.517 ' HG3' HG11 ' A' ' 19' ' ' VAL . 25.6 mmt180 -80.26 -44.53 19.5 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.045 0.938 . . . . 75.209999999999994 111.233 -178.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.7 98.26 43.96 Favored Pre-proline 0 N--CA 1.487 1.389 0 C-N-CA 123.038 0.535 . . . . 63.329999999999998 110.736 176.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.72 -8.68 23.59 Favored 'Trans proline' 0 C--N 1.378 2.102 0 C-N-CA 122.822 2.348 . . . . 73.150000000000006 114.002 168.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -108.21 28.54 8.2 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.379 0.536 . . . . 63.420000000000002 111.063 177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -81.03 42.43 0.64 Allowed 'General case' 0 CA--C 1.557 1.23 0 C-N-CA 125.015 1.326 . . . . 70.019999999999996 113.922 -169.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.94 -33.06 64.38 Favored 'General case' 0 CA--C 1.549 0.937 0 N-CA-C 114.028 1.122 . . . . 73.219999999999999 114.028 -175.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -22.34 41.9 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 122.597 0.359 . . . . 74.510000000000005 111.619 177.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.07 -28.25 67.21 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 122.892 0.477 . . . . 75.409999999999997 109.927 173.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -69.03 -26.75 65.14 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.345 -0.843 . . . . 73.129999999999995 110.992 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 m -63.98 -35.36 80.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.437 0.295 . . . . 70.340000000000003 110.305 171.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -73.02 -34.01 66.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.967 0.907 . . . . 71.400000000000006 110.691 176.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.42 HH22 ' CD ' ' A' ' 75' ' ' GLU . 39.9 ttp180 -68.16 -43.49 78.11 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.843 0.857 . . . . 60.130000000000003 109.979 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.44 -37.23 86.47 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.956 0.902 . . . . 74.010000000000005 110.963 171.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.95 -19.05 64.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.874 0.87 . . . . 72.030000000000001 111.762 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 83.4 m -80.22 -52.13 8.11 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.548 -0.538 . . . . 72.299999999999997 109.548 169.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -54.58 -27.79 41.51 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.369 1.067 . . . . 65.329999999999998 113.537 -175.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 33.9 p -60.58 -48.91 79.7 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 122.595 0.358 . . . . 73.140000000000001 110.581 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -70.54 -27.36 64.09 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 121.339 0.59 . . . . 74.129999999999995 110.336 -178.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -86.9 -0.1 55.93 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 115.254 -0.885 . . . . 74.349999999999994 110.787 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 67.06 7.24 5.26 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 125.056 1.342 . . . . 62.299999999999997 112.945 179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -88.38 50.1 1.91 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.402 1.081 . . . . 71.540000000000006 110.232 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 88.1 m-85 -58.25 -25.91 62.27 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.716 0.806 . . . . 72.329999999999998 111.568 179.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.6 mm-40 -57.7 -42.34 83.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.566 0.746 . . . . 74.439999999999998 110.569 173.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 33.5 mt -72.85 -37.09 67.54 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.113 -0.949 . . . . 53.200000000000003 109.424 178.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.74 -30.68 71.37 Favored 'General case' 0 N--CA 1.483 1.211 0 O-C-N 124.222 0.951 . . . . 52.030000000000001 112.527 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 91.7 mt -65.03 -60.66 2.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-O 121.479 0.657 . . . . 63.149999999999999 110.114 175.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -69.86 -19.37 63.45 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 115.345 -0.843 . . . . 72.239999999999995 111.984 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 68' ' ' LEU . 32.1 t0 -60.63 -49.0 79.27 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 108.504 -0.924 . . . . 72.420000000000002 108.504 171.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 68.6 m -65.12 -41.18 95.09 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 115.165 -0.925 . . . . 61.439999999999998 110.609 177.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -65.83 -28.22 68.82 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 113.027 0.751 . . . . 74.409999999999997 113.027 -177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' CD ' HH22 ' A' ' 56' ' ' ARG . 11.8 pt-20 -86.55 -47.5 9.18 Favored 'General case' 0 N--CA 1.484 1.233 0 CA-C-N 118.277 0.49 . . . . 74.209999999999994 111.169 178.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 25.3 p -68.75 -22.19 64.32 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 112.342 0.497 . . . . 64.040000000000006 112.342 -173.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -31.06 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.052 0.541 . . . . 72.109999999999999 110.306 173.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -67.54 -31.92 72.34 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.155 0.582 . . . . 63.310000000000002 111.299 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -90.96 -30.47 16.83 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.619 0.767 . . . . 72.239999999999995 111.326 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -151.05 106.28 3.0 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 123.909 0.884 . . . . 75.319999999999993 109.491 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.93 -19.03 35.86 Favored 'Trans proline' 0 CA--C 1.55 1.3 0 C-N-CA 122.034 1.822 . . . . 65.239999999999995 113.993 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.417 HG22 HD22 ' A' ' 113' ' ' LEU . 82.1 p -108.08 19.04 20.47 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.702 0.63 . . . . 45.43 112.702 -172.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.404 ' CE2' ' SG ' ' A' ' 76' ' ' CYS . 9.6 p90 -62.94 108.93 1.31 Allowed 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 121.861 0.839 . . . . 73.409999999999997 109.561 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 114' ' ' ASP . 27.2 mt -75.93 -51.02 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.395 0.678 . . . . 73.340000000000003 112.61 -165.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -68.55 -29.82 68.47 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 122.416 0.286 . . . . 72.329999999999998 111.241 -172.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -72.21 -33.45 61.93 Favored Glycine 0 C--N 1.344 1.019 0 O-C-N 123.556 0.535 . . . . 42.210000000000001 112.454 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -61.54 -46.69 88.86 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.818 0.447 . . . . 65.299999999999997 110.586 170.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 m -68.82 -31.21 70.04 Favored 'General case' 0 CA--C 1.556 1.178 0 C-N-CA 122.509 0.323 . . . . 51.329999999999998 110.493 -178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.32 -31.98 62.66 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.098 0.959 . . . . 73.239999999999995 111.172 174.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -69.27 -44.78 71.2 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.714 0.806 . . . . 74.530000000000001 109.597 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.555 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.67 -31.4 68.29 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.942 -1.026 . . . . 75.049999999999997 110.783 178.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.36 87.5 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.635 0.774 . . . . 71.439999999999998 111.087 173.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -65.14 -51.92 58.31 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 114.943 -1.026 . . . . 54.439999999999998 109.909 177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 99' ' ' ASP . 82.6 mt -57.84 -40.18 79.44 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.632 0.773 . . . . 74.120000000000005 111.606 178.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -56.01 -37.61 69.37 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.255 0.622 . . . . 64.439999999999998 110.811 173.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.36 -20.29 51.61 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.012 0.525 . . . . 72.319999999999993 110.416 177.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 22.3 mmt -93.98 8.73 40.31 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.734 0.813 . . . . 53.109999999999999 110.416 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm 68.43 12.66 8.8 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 125.086 1.354 . . . . 65.200000000000003 112.882 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 94' ' ' LEU . 19.9 t0 -90.52 42.6 1.11 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.487 1.115 . . . . 72.209999999999994 111.296 -175.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -48.7 -32.29 8.18 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.201 1.0 . . . . 72.099999999999994 112.949 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 42.0 p -59.52 -46.06 89.96 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.239 1.016 . . . . 64.450000000000003 111.746 178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.476 ' O ' HG23 ' A' ' 106' ' ' VAL . 5.6 mmpt? -87.98 -30.15 20.22 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.325 0.25 . . . . 61.439999999999998 110.607 -178.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.72 -49.84 76.16 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.335 0.654 . . . . 50.130000000000003 110.161 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.41 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 19.0 ptp -60.18 -30.03 69.08 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 124.037 0.835 . . . . 73.150000000000006 111.695 -179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 76.4 m-20 -67.05 -41.12 87.05 Favored 'General case' 0 C--N 1.356 0.848 0 O-C-N 123.698 0.624 . . . . 74.019999999999996 110.435 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.555 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 43.1 t -77.68 -31.12 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 N-CA-C 109.904 -0.406 . . . . 63.0 109.904 -174.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.635 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 51.2 m-85 -62.05 -47.72 83.43 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.116 0.566 . . . . 74.409999999999997 109.897 171.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -61.68 -50.2 73.43 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.214 1.006 . . . . 63.340000000000003 109.845 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.6 mmmt -65.39 -32.9 74.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.253 0.621 . . . . 70.150000000000006 111.848 -178.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.545 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.06 -41.27 86.73 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 123.594 0.559 . . . . 54.030000000000001 110.779 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.2 -36.26 81.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.943 0.497 . . . . 74.120000000000005 110.763 172.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -69.98 -20.26 63.31 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.723 1.209 . . . . 50.229999999999997 111.582 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 83.3 mt -70.54 -63.72 1.04 Allowed 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 109.732 -0.47 . . . . 64.400000000000006 109.732 173.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.544 ' HB3' HD11 ' A' ' 84' ' ' ILE . 22.9 t70 -166.53 156.67 11.91 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.449 0.699 . . . . 62.109999999999999 110.362 178.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.478 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 23.3 p -64.07 -10.53 22.77 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.632 1.173 . . . . 72.200000000000003 113.251 -177.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 63.7 m -61.64 -8.16 4.21 Favored 'General case' 0 N--CA 1.484 1.234 0 O-C-N 121.729 -0.607 . . . . 70.430000000000007 111.83 168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.545 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 37.7 t -95.85 11.09 34.96 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.761 1.023 . . . . 54.310000000000002 113.761 174.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 115' ' ' SER . 28.9 mmmt -45.2 -31.69 1.59 Allowed 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 114.411 1.263 . . . . 73.439999999999998 114.411 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -55.08 -34.27 63.48 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 124.201 1.0 . . . . 72.209999999999994 112.966 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.5 -20.85 64.61 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.651 1.18 . . . . 50.310000000000002 113.012 179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -65.75 -46.38 79.07 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.788 -0.449 . . . . 44.299999999999997 109.788 176.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.49 -35.45 79.18 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 115.433 -0.803 . . . . 73.030000000000001 110.657 178.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.5 -31.25 68.28 Favored Glycine 0 C--N 1.354 1.555 0 CA-C-N 115.554 -0.748 . . . . 10.32 113.194 177.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 13.1 t80 -61.03 -58.43 8.45 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 123.729 0.812 . . . . 74.349999999999994 110.215 175.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.56 -34.72 37.97 Favored 'General case' 0 N--CA 1.483 1.184 0 O-C-N 123.95 0.781 . . . . 72.120000000000005 112.142 177.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -71.79 -34.66 69.6 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 122.593 0.357 . . . . 75.420000000000002 111.436 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.635 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 63.1 m -77.83 -47.35 19.07 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.405 0.282 . . . . 72.400000000000006 111.047 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 16.8 ptm -59.88 -39.17 84.36 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 123.614 0.571 . . . . 72.420000000000002 110.951 176.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -75.63 -29.13 59.06 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.511 -0.281 . . . . 74.409999999999997 111.3 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.91 -44.68 96.83 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.191 0.597 . . . . 73.230000000000004 111.844 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -71.12 -15.86 62.53 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.16 -0.927 . . . . 63.439999999999998 111.48 174.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.9 m-30 -107.49 36.26 2.78 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.071 0.548 . . . . 60.219999999999999 109.956 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 124.248 1.019 . . . . 70.140000000000001 108.318 173.063 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.6 mtt . . . . . 0 N--CA 1.484 1.275 0 N-CA-C 110.23 -0.285 . . . . 72.120000000000005 110.23 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 78.7 60.42 2.62 Favored Glycine 0 C--N 1.346 1.126 0 N-CA-C 111.116 -0.793 . . . . 62.049999999999997 111.116 -173.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -63.62 98.05 0.17 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.638 0.775 . . . . 74.230000000000004 109.723 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.3 p80 -99.05 158.82 15.4 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.072 0.949 . . . . 73.540000000000006 110.854 -174.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.466 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 33.9 t60 -154.31 156.04 36.24 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 107.569 -1.271 . . . . 55.43 107.569 177.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.0 m170 -56.59 130.79 46.69 Favored 'General case' 0 N--CA 1.48 1.069 0 O-C-N 123.368 0.417 . . . . 73.310000000000002 110.58 176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -78.6 -18.72 54.14 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.909 0.484 . . . . 64.209999999999994 112.174 -170.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -89.35 -1.73 58.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.004 0.522 . . . . 74.439999999999998 111.529 172.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.1 t -89.3 120.39 30.61 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.648 -0.871 . . . . 75.150000000000006 108.648 177.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.9 m170 -86.41 55.06 3.38 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-O 122.015 0.912 . . . . 74.5 109.866 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.3 mtt -119.94 -52.33 2.21 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 124.883 1.273 . . . . 75.129999999999995 108.851 177.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 62.46 143.81 0.07 OUTLIER Pre-proline 0 N--CA 1.481 1.115 0 C-N-CA 125.252 1.421 . . . . 61.450000000000003 112.64 -172.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.466 ' HG3' ' HB2' ' A' ' 5' ' ' HIS . 14.3 Cg_exo -66.47 -42.03 10.62 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.872 1.714 . . . . 72.400000000000006 110.664 171.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.427 ' HB3' ' HB3' ' A' ' 17' ' ' LEU . 19.0 t0 -179.9 119.43 0.06 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.322 1.049 . . . . 72.409999999999997 110.185 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.1 mp -60.03 -37.74 80.69 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.408 0.683 . . . . 73.129999999999995 111.646 176.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -18.31 64.66 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.062 0.545 . . . . 64.099999999999994 111.087 176.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.555 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -85.06 -27.28 26.43 Favored 'General case' 0 CA--C 1.547 0.864 0 N-CA-C 109.398 -0.593 . . . . 75.209999999999994 109.398 173.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.9 mmt -75.38 -34.3 61.09 Favored 'General case' 0 N--CA 1.479 0.983 0 O-C-N 121.838 -0.539 . . . . 74.430000000000007 110.288 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.552 HG11 ' HG3' ' A' ' 45' ' ' ARG . 9.2 p -70.79 -29.17 36.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 122.918 0.487 . . . . 62.219999999999999 111.032 178.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.555 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.9 ptpt -80.18 -23.84 40.75 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.973 -0.38 . . . . 75.019999999999996 109.973 175.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -66.1 -46.97 75.73 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.717 0.407 . . . . 72.140000000000001 110.243 175.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.8 ptmm? -70.56 -32.42 69.82 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.756 0.422 . . . . 75.409999999999997 110.672 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.77 -53.57 44.81 Favored Glycine 0 CA--C 1.537 1.458 0 O-C-N 123.585 0.553 . . . . 70.25 112.543 172.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -58.45 -42.17 86.77 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.773 1.229 . . . . 44.32 111.312 175.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.1 tt0 -64.3 -45.42 88.07 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 124.21 0.944 . . . . 73.409999999999997 110.384 -177.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.6 m -55.62 -49.56 72.49 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.849 0.718 . . . . 61.039999999999999 111.583 -177.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -57.25 -46.62 82.85 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 124.062 0.851 . . . . 74.230000000000004 109.964 176.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -64.47 -21.31 66.63 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 125.026 1.33 . . . . 55.439999999999998 112.008 177.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.7 mmmt -78.28 -17.7 56.27 Favored 'General case' 0 C--N 1.366 1.321 0 CA-C-N 118.162 0.437 . . . . 63.140000000000001 110.415 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.9 -3.44 30.32 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 116.079 -0.51 . . . . 53.299999999999997 112.498 -176.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' ALA . 11.3 t70 -82.46 95.11 7.59 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.098 -1.075 . . . . 74.540000000000006 108.098 170.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -81.24 -49.69 0.99 Allowed Pre-proline 0 CA--C 1.561 1.384 0 CA-C-O 118.06 -0.972 . . . . 64.349999999999994 112.318 176.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -64.07 -58.6 0.24 Allowed 'Trans proline' 0 C--N 1.398 3.136 0 C-N-CA 121.562 1.508 . . . . 74.549999999999997 112.332 -173.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -73.18 -14.74 61.42 Favored 'General case' 0 C--N 1.35 0.617 0 CA-C-O 119.03 -0.51 . . . . 70.040000000000006 110.825 -173.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.47 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -56.76 -33.75 66.9 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.117 0.567 . . . . 64.150000000000006 110.833 170.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.53 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 39.0 ttp -60.55 -40.69 92.5 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 123.811 0.694 . . . . 71.430000000000007 110.146 174.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -72.92 -33.91 66.27 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.173 0.989 . . . . 64.109999999999999 111.122 177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -72.38 -21.14 61.33 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.738 0.815 . . . . 70.150000000000006 110.955 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -84.02 -35.33 23.95 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 123.157 0.583 . . . . 65.040000000000006 110.529 169.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 96.7 m -61.95 -42.17 98.82 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.575 0.35 . . . . 61.020000000000003 111.19 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -63.35 -31.83 73.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.881 0.472 . . . . 72.439999999999998 110.628 175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.29 72.02 Favored 'General case' 0 C--N 1.349 0.556 0 C-N-CA 123.313 0.645 . . . . 71.219999999999999 110.838 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.34 -30.54 50.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 C-N-CA 124.553 1.141 . . . . 54.509999999999998 109.986 174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 34.3 mmtp -71.45 -25.86 62.48 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.74 0.416 . . . . 53.329999999999998 111.041 176.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.552 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.0 mmt180 -84.81 -37.74 20.39 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.746 0.818 . . . . 63.439999999999998 111.004 175.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.61 82.67 15.66 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 123.308 0.643 . . . . 51.219999999999999 111.336 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -72.42 -14.0 27.88 Favored 'Trans proline' 0 C--N 1.379 2.144 0 C-N-CA 122.469 2.113 . . . . 42.329999999999998 111.665 173.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HA ' HD22 ' A' ' 79' ' ' LEU . 14.0 mmmm -82.94 -10.36 58.84 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.914 1.286 . . . . 73.109999999999999 111.936 178.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -82.96 125.21 31.15 Favored 'General case' 0 C--N 1.349 0.577 0 O-C-N 123.403 0.439 . . . . 71.439999999999998 109.841 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -76.98 -61.7 1.89 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.368 0.667 . . . . 61.100000000000001 112.7 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -16.77 64.53 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.962 0.356 . . . . 74.409999999999997 111.962 -168.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.79 -38.04 83.97 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.241 0.617 . . . . 70.140000000000001 112.166 172.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -69.28 -32.84 72.26 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.349 0.66 . . . . 74.109999999999999 110.413 171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.4 m -71.73 -27.01 62.71 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 123.82 0.848 . . . . 73.010000000000005 111.428 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -77.2 -32.93 56.32 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.373 1.069 . . . . 65.109999999999999 109.669 174.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -66.49 -38.88 88.24 Favored 'General case' 0 C--N 1.357 0.932 0 N-CA-C 109.054 -0.721 . . . . 52.109999999999999 109.054 169.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.09 -33.12 75.28 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.027 0.931 . . . . 74.319999999999993 111.255 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.08 -33.25 74.07 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.823 0.849 . . . . 74.120000000000005 111.169 172.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 49.4 t -77.69 -45.38 25.03 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.745 0.818 . . . . 71.549999999999997 110.811 175.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.53 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 19.5 m-85 -61.02 -38.25 85.44 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.73 0.812 . . . . 70.340000000000003 112.081 -172.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.2 p -55.51 -42.54 74.62 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 122.952 0.501 . . . . 73.019999999999996 110.805 174.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -68.13 -35.93 78.89 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.63 0.772 . . . . 51.130000000000003 109.762 -178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 71.2 mt -84.09 -0.58 52.45 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 114.669 -1.15 . . . . 74.299999999999997 111.306 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 68.3 10.79 8.06 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.308 1.043 . . . . 75.319999999999993 111.942 -176.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.52 45.82 1.09 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.943 1.697 . . . . 73.219999999999999 111.605 176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 87.4 m-85 -57.02 -28.95 62.94 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.865 0.866 . . . . 75.540000000000006 111.849 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -59.28 -38.54 80.42 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.364 0.666 . . . . 73.230000000000004 111.184 176.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 19.7 mt -76.11 -41.99 48.53 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.258 -0.645 . . . . 54.530000000000001 109.258 178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.32 -33.92 66.06 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.906 0.883 . . . . 63.409999999999997 112.003 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 96.0 mt -65.18 -60.37 3.07 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.444 0.697 . . . . 62.539999999999999 111.319 173.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -66.65 -18.69 65.5 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.716 0.635 . . . . 71.310000000000002 112.716 -176.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.22 -49.48 56.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.839 0.855 . . . . 73.019999999999996 110.499 171.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 31.8 p -67.02 -30.93 71.16 Favored 'General case' 0 N--CA 1.478 0.94 0 O-C-N 123.045 0.216 . . . . 73.310000000000002 110.815 178.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -72.35 -29.57 63.93 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 113.203 0.816 . . . . 73.129999999999995 113.203 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -87.47 -41.22 13.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 121.851 -0.531 . . . . 73.5 110.707 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 29.9 p -67.72 -23.99 65.33 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.037 0.535 . . . . 64.540000000000006 112.388 -173.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -36.06 64.68 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 N-CA-C 109.746 -0.465 . . . . 53.0 109.746 173.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -75.32 -22.04 57.97 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.338 0.655 . . . . 73.209999999999994 111.081 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' A' ' 48' ' ' LYS . 71.5 mt -82.64 -52.36 6.87 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.818 0.847 . . . . 72.329999999999998 110.456 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -151.71 104.72 2.87 Favored Pre-proline 0 CA--C 1.545 0.761 0 CA-C-N 115.261 -0.881 . . . . 63.240000000000002 108.656 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.58 -15.14 46.74 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.954 2.436 . . . . 55.43 114.227 -179.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.469 ' HA ' HD22 ' A' ' 113' ' ' LEU . 60.9 p -87.81 15.85 6.54 Favored 'General case' 0 N--CA 1.485 1.324 0 CA-C-N 118.292 0.496 . . . . 75.239999999999995 111.963 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 4.1 p90 -66.46 112.64 4.18 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 121.76 0.79 . . . . 61.549999999999997 109.984 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.637 HG23 ' SG ' ' A' ' 117' ' ' CYS . 17.3 mt -82.5 -45.74 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.468 0.707 . . . . 72.230000000000004 110.47 -174.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 74.8 mmtt -59.94 -28.86 67.98 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 124.176 0.923 . . . . 73.109999999999999 111.908 -175.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.475 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -70.52 -42.44 63.81 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 119.22 -0.766 . . . . 62.340000000000003 113.423 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.415 ' HD1' HG13 ' A' ' 106' ' ' VAL . 56.3 m-85 -71.13 -25.41 62.56 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.864 0.466 . . . . 72.010000000000005 111.932 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 120' ' ' ALA . 69.0 p -81.37 -33.87 32.07 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 122.46 0.304 . . . . 64.230000000000004 110.598 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 65.4 mmt-85 -80.93 -18.12 48.19 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.091 0.556 . . . . 74.010000000000005 110.539 171.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.59 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 59.1 tptt -71.19 -51.11 26.65 Favored 'General case' 0 C--N 1.35 0.63 0 C-N-CA 123.812 0.845 . . . . 71.120000000000005 109.354 176.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -58.78 -35.3 72.58 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.842 0.714 . . . . 61.020000000000003 110.976 175.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.31 -38.18 81.32 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.981 0.913 . . . . 63.130000000000003 111.844 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.77 -52.0 35.15 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.919 0.488 . . . . 53.039999999999999 110.203 177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.4 mt -54.82 -39.46 68.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.804 1.242 . . . . 65.099999999999994 111.177 177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.439 ' HG3' ' HE1' ' A' ' 100' ' ' TYR . 34.9 tt0 -52.12 -42.58 63.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.984 0.803 . . . . 65.349999999999994 111.631 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.27 -23.37 59.11 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 122.961 0.505 . . . . 72.019999999999996 110.404 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -94.2 1.55 56.02 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.702 0.801 . . . . 64.439999999999998 109.981 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 68.07 18.63 9.4 Favored 'General case' 0 C--N 1.369 1.44 0 C-N-CA 125.918 1.687 . . . . 73.329999999999998 112.462 176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 22.1 m-20 -89.28 50.04 1.86 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.942 1.297 . . . . 63.219999999999999 111.142 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.439 ' HE1' ' HG3' ' A' ' 95' ' ' GLU . 19.5 m-85 -57.19 -36.77 71.23 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.741 0.816 . . . . 65.129999999999995 111.974 176.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 47.1 p -63.43 -25.09 68.12 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.902 0.881 . . . . 75.099999999999994 111.756 176.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -87.93 -41.4 13.2 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.274 0.629 . . . . 72.049999999999997 109.793 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.527 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -63.49 -37.8 88.68 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.223 1.009 . . . . 52.549999999999997 111.963 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.7 ptp -64.45 -20.14 65.99 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.571 0.749 . . . . 74.340000000000003 112.727 177.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -83.44 -30.54 27.2 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 121.904 -0.498 . . . . 71.340000000000003 110.706 170.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.415 HG13 ' HD1' ' A' ' 87' ' ' TYR . 75.0 t -78.46 -34.83 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 C-N-CA 123.516 0.726 . . . . 71.540000000000006 110.668 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -63.71 -36.78 84.97 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.189 -0.671 . . . . 71.209999999999994 109.189 176.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -65.7 -46.78 77.7 Favored 'General case' 0 C--N 1.355 0.844 0 CA-C-N 114.768 -1.106 . . . . 74.510000000000005 108.469 -179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.453 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.6 mmmt -62.31 -33.1 74.02 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.98 0.8 . . . . 73.430000000000007 112.645 175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.842 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -68.44 -44.33 75.15 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.323 0.649 . . . . 54.450000000000003 111.139 177.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.9 mt -68.19 -32.37 72.55 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.435 0.694 . . . . 72.329999999999998 111.202 174.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -61.22 -29.34 69.77 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.746 1.218 . . . . 63.439999999999998 110.473 179.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.469 HD22 ' HA ' ' A' ' 82' ' ' THR . 66.9 mt -72.08 -54.7 9.03 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.253 0.621 . . . . 72.430000000000007 110.044 173.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -165.1 147.1 7.87 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.006 0.523 . . . . 71.230000000000004 110.173 175.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 56.4 p -64.67 -26.34 68.34 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.146 0.979 . . . . 75.120000000000005 112.247 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 t -62.86 -6.18 3.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.023 0.929 . . . . 53.109999999999999 111.705 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.842 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.7 t -80.6 17.04 1.19 Allowed 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.121 0.968 . . . . 73.310000000000002 112.104 169.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -40.38 -27.32 0.05 OUTLIER 'General case' 0 N--CA 1.506 2.358 0 N-CA-C 114.872 1.434 . . . . 72.329999999999998 114.872 172.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -56.75 -33.17 66.29 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.838 0.855 . . . . 54.439999999999998 112.033 176.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.567 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -71.09 -31.45 67.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.676 0.79 . . . . 65.109999999999999 111.432 172.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.37 -41.53 66.26 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.988 0.515 . . . . 53.310000000000002 110.018 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -57.0 -46.24 82.44 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.486 1.114 . . . . 63.009999999999998 109.756 170.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.01 -26.99 72.49 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 114.91 -1.041 . . . . 74.340000000000003 113.272 177.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.407 ' O ' ' HG2' ' A' ' 128' ' ' MET . 27.4 t80 -64.3 -53.13 53.75 Favored 'General case' 0 C--N 1.359 0.998 0 CA-C-O 118.732 -0.652 . . . . 74.450000000000003 111.481 176.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -50.95 -39.2 54.49 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 123.521 0.513 . . . . 74.420000000000002 111.068 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.1 ttt85 -68.44 -39.21 81.61 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 124.35 1.06 . . . . 73.510000000000005 111.775 175.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.527 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 34.0 t -72.79 -50.73 22.47 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.958 0.903 . . . . 61.0 111.318 -172.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 124' ' ' TYR . 22.4 ptm -64.31 -43.68 93.97 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.163 0.585 . . . . 73.140000000000001 111.206 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.4 ptm -68.35 -26.52 65.64 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 111.454 0.168 . . . . 63.240000000000002 111.454 -178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.45 71.47 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.682 0.793 . . . . 42.119999999999997 112.263 -175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -94.31 -12.51 27.9 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.211 0.605 . . . . 72.439999999999998 111.304 173.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 14.1 m-30 -102.91 44.73 0.99 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.302 0.641 . . . . 74.219999999999999 109.606 179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 14.9 m120 . . . . . 0 C--O 1.249 1.07 0 C-N-CA 123.988 0.915 . . . . 74.129999999999995 109.153 176.266 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 110.003 -0.369 . . . . 71.019999999999996 110.003 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 79.19 -90.4 1.21 Allowed Glycine 0 C--N 1.349 1.277 0 CA-C-O 119.782 -0.455 . . . . 73.349999999999994 112.821 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.9 p80 40.66 66.41 0.64 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 125.829 1.652 . . . . 73.230000000000004 112.277 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -148.49 -60.6 0.24 Allowed 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.954 -1.021 . . . . 74.150000000000006 109.241 -174.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 81.6 t60 -162.23 125.83 3.06 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.027 0.931 . . . . 73.120000000000005 108.645 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 p-80 -66.75 89.67 0.16 Allowed 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.902 0.858 . . . . 75.0 109.165 176.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -74.27 132.8 42.44 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.884 -1.053 . . . . 74.099999999999994 111.173 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -143.54 148.69 36.35 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.513 1.125 . . . . 65.230000000000004 109.362 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -88.32 -167.91 2.04 Favored 'General case' 0 C--O 1.248 1.022 0 C-N-CA 123.702 0.801 . . . . 74.510000000000005 109.915 177.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.559 ' HA ' HD11 ' A' ' 15' ' ' LEU . 7.6 t60 -80.73 62.37 4.74 Favored 'General case' 0 CA--C 1.552 1.056 0 CA-C-O 121.967 0.889 . . . . 73.409999999999997 109.052 174.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.0 mmt -103.29 -25.68 13.23 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.365 1.066 . . . . 72.140000000000001 109.466 176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.413 HD22 ' HG3' ' A' ' 18' ' ' MET . 1.4 m-20 -67.31 143.83 97.68 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-N 115.47 -0.786 . . . . 64.340000000000003 108.917 173.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -60.6 -27.61 85.14 Favored 'Trans proline' 0 C--N 1.377 2.076 0 C-N-CA 122.665 2.243 . . . . 53.32 112.232 -178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.533 ' HB3' HD23 ' A' ' 17' ' ' LEU . 33.0 t70 -167.48 102.91 0.51 Allowed 'General case' 0 C--N 1.344 0.332 0 C-N-CA 123.974 0.91 . . . . 74.010000000000005 108.586 176.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 10' ' ' HIS . 5.5 mp -62.74 -24.32 67.64 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.336 0.654 . . . . 64.530000000000001 111.274 177.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.57 -26.0 67.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.346 0.658 . . . . 75.230000000000004 111.756 174.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.96 -18.38 43.67 Favored 'General case' 0 C--N 1.353 0.726 0 N-CA-C 110.203 -0.295 . . . . 71.319999999999993 110.203 176.78 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.413 ' HG3' HD22 ' A' ' 12' ' ' ASN . 25.1 mmt -82.82 -39.09 22.17 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.264 0.625 . . . . 60.5 110.949 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.615 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.5 p -71.92 -21.82 21.07 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 CA-C-N 115.191 -0.913 . . . . 73.409999999999997 111.651 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -78.69 -26.21 44.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.78 -0.575 . . . . 72.519999999999996 110.662 174.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -73.03 -25.5 60.97 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.563 -0.744 . . . . 72.530000000000001 111.833 -177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.533 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 20.6 ptmt -76.47 -30.25 57.22 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 117.938 0.336 . . . . 73.430000000000007 110.24 178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -65.51 -45.33 90.42 Favored Glycine 0 C--N 1.352 1.435 0 N-CA-C 111.406 -0.678 . . . . 75.25 111.406 170.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -60.59 -37.88 82.8 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.757 0.823 . . . . 60.229999999999997 110.711 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.2 OUTLIER -62.42 -44.18 97.05 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.781 0.832 . . . . 64.219999999999999 110.664 179.345 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.456 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 73.0 m -58.31 -39.41 79.32 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 123.357 0.411 . . . . 64.230000000000004 112.008 -179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -55.24 -39.58 69.89 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.608 0.363 . . . . 74.349999999999994 111.712 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -63.83 -25.47 68.19 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.133 0.573 . . . . 74.25 110.843 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.99 -10.44 39.27 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 109.588 -0.523 . . . . 74.099999999999994 109.588 -176.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.77 5.71 53.37 Favored Glycine 0 C--N 1.357 1.738 0 O-C-N 123.311 0.382 . . . . 63.140000000000001 112.96 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -97.68 97.66 9.21 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.509 0.724 . . . . 70.519999999999996 111.47 -174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -76.58 -48.03 3.06 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.856 0.863 . . . . 73.349999999999994 112.228 174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.21 -53.47 3.54 Favored 'Trans proline' 0 C--N 1.398 3.16 0 C-N-CA 121.777 1.651 . . . . 73.420000000000002 111.893 176.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.9 tp60 -52.16 -42.98 63.85 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.187 0.995 . . . . 61.140000000000001 111.493 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.66 -43.09 72.09 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.025 0.828 . . . . 52.509999999999998 111.791 176.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.521 ' HB2' ' SG ' ' A' ' 59' ' ' CYS . 42.5 ttp -68.84 -37.95 79.47 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.98 0.912 . . . . 64.420000000000002 110.113 -176.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -67.97 -39.61 83.32 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.466 0.706 . . . . 72.019999999999996 110.698 178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.471 ' ND1' ' HE2' ' A' ' 22' ' ' LYS . 93.1 m-70 -72.19 -20.78 61.53 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 116.013 -0.54 . . . . 75.409999999999997 111.658 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -76.4 -27.75 56.44 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-O 118.676 -0.678 . . . . 73.310000000000002 111.33 169.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.437 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.0 m -62.06 -46.5 88.83 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 118.404 0.547 . . . . 63.32 110.255 178.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.63 -27.24 62.96 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.672 -0.694 . . . . 65.340000000000003 110.963 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.74 79.3 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.929 0.492 . . . . 62.520000000000003 110.993 175.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 81.7 mt -62.01 -35.48 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.471 1.108 . . . . 72.329999999999998 110.407 175.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -65.54 -16.23 63.48 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-N 116.388 -0.369 . . . . 72.129999999999995 111.794 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.615 ' HG3' HG11 ' A' ' 19' ' ' VAL . 42.1 mmt180 -98.8 -40.28 8.21 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.927 0.891 . . . . 75.230000000000004 110.891 177.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.78 73.15 40.81 Favored Pre-proline 0 N--CA 1.482 1.152 0 C-N-CA 123.016 0.527 . . . . 63.130000000000003 111.561 -176.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -76.63 -18.48 15.31 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.437 2.091 . . . . 72.319999999999993 113.356 -173.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 pptp? -86.31 -10.51 54.33 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 122.737 0.415 . . . . 71.420000000000002 111.032 -176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.428 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.9 m-20 -80.96 96.53 7.11 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.836 0.854 . . . . 64.420000000000002 110.425 176.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.495 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -71.66 -17.25 62.26 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.739 0.815 . . . . 75.319999999999993 112.769 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -22.56 65.55 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 118.391 0.542 . . . . 74.5 111.001 173.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 20' ' ' LYS . 4.6 mm? -70.21 -36.34 74.5 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-O 121.297 0.57 . . . . 74.109999999999999 109.867 170.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.495 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 70.0 m-85 -76.24 -16.49 59.81 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 114.592 -1.185 . . . . 75.230000000000004 111.97 176.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.3 t -64.71 -39.87 94.39 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.35 -0.611 . . . . 63.340000000000003 109.35 168.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -76.63 -29.99 56.69 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.642 0.777 . . . . 73.430000000000007 111.052 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -68.09 -51.37 47.14 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 63.219999999999999 109.729 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.71 -35.26 80.47 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.044 -0.98 . . . . 64.109999999999999 111.072 176.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HH11 ' A' ' 89' ' ' ARG . . . -65.9 -35.54 80.91 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.027 0.531 . . . . 72.329999999999998 111.308 176.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 36' ' ' MET . 42.3 t -65.03 -51.28 62.49 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 108.715 -0.846 . . . . 74.409999999999997 108.715 174.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -53.02 -43.45 66.54 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.726 0.81 . . . . 64.540000000000006 112.539 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -61.28 -38.02 85.25 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 122.175 0.19 . . . . 73.329999999999998 111.385 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -75.64 -25.75 57.14 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-O 120.947 0.404 . . . . 51.119999999999997 110.592 -177.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -88.05 2.05 52.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.023 0.929 . . . . 62.439999999999998 110.773 174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 73.2 7.47 5.29 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 125.087 1.355 . . . . 71.540000000000006 112.678 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.63 54.1 3.05 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.585 1.154 . . . . 74.430000000000007 111.41 175.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.01 -27.35 63.45 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.316 0.646 . . . . 71.519999999999996 111.348 176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -56.29 -43.98 79.41 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.453 0.701 . . . . 73.439999999999998 110.722 173.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 30.1 mt -76.12 -37.24 58.32 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 115.839 -0.619 . . . . 74.519999999999996 109.511 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.11 -38.3 88.37 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 124.153 0.908 . . . . 53.509999999999998 112.316 -177.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 74' ' ' GLU . 96.1 mt -59.98 -66.69 0.48 Allowed 'General case' 0 C--N 1.357 0.915 0 O-C-N 123.536 0.523 . . . . 71.450000000000003 109.765 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -66.93 -22.59 65.94 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 115.336 -0.847 . . . . 74.530000000000001 112.852 -171.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.464 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 21.5 t70 -61.43 -60.55 3.54 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 108.822 -0.807 . . . . 74.329999999999998 108.822 175.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.656 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 31.8 p -66.34 -30.65 71.09 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 116.041 -0.527 . . . . 75.230000000000004 111.343 -179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 70' ' ' LEU . 58.3 mt-10 -69.51 -28.6 66.19 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 112.751 0.649 . . . . 74.430000000000007 112.751 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -88.05 -34.38 18.0 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.774 0.716 . . . . 74.530000000000001 110.187 172.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 72' ' ' ASP . 83.1 m -67.4 -21.99 65.57 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.682 0.793 . . . . 61.0 112.859 -177.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.0 OUTLIER -60.19 -31.23 47.68 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 123.161 0.584 . . . . 73.030000000000001 110.174 172.578 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -75.19 -20.36 59.35 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.671 0.788 . . . . 73.019999999999996 111.262 -179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 42.4 mt -85.1 -51.74 6.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 121.806 0.812 . . . . 74.329999999999998 109.458 176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -152.21 105.23 2.78 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 114.148 -1.387 . . . . 72.0 108.478 -172.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -82.35 5.32 6.44 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 122.749 2.3 . . . . 74.329999999999998 113.864 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.2 p -100.77 13.28 35.46 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.063 0.545 . . . . 74.25 112.423 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CD2' ' HA3' ' A' ' 86' ' ' GLY . 9.9 p90 -83.36 90.85 7.22 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 123.003 1.383 . . . . 71.319999999999993 110.199 -178.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 114' ' ' ASP . 54.4 mt -71.49 -39.2 70.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 CA-C-N 115.033 -0.985 . . . . 73.150000000000006 112.156 -161.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.49 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 4.2 mptp? -74.14 -27.6 60.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.548 -0.751 . . . . 75.099999999999994 110.114 -176.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.412 ' HA3' ' CD2' ' A' ' 83' ' ' PHE . . . -67.67 -26.58 73.72 Favored Glycine 0 C--N 1.351 1.397 0 O-C-N 124.018 0.824 . . . . 44.219999999999999 113.018 177.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -68.75 -39.06 80.48 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 122.763 0.425 . . . . 54.210000000000001 110.743 170.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 30.5 m -66.83 -32.53 73.86 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 122.698 0.399 . . . . 70.219999999999999 110.681 175.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.573 HH11 ' HB2' ' A' ' 58' ' ' ALA . 12.3 mmt85 -70.13 -39.63 75.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.211 0.604 . . . . 73.129999999999995 109.889 175.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.656 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 22.9 tptm -65.64 -40.67 92.75 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.05 0.94 . . . . 74.430000000000007 110.54 178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.22 -39.25 82.41 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.287 0.635 . . . . 62.439999999999998 110.483 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.04 -31.76 70.76 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.8 0.84 . . . . 51.539999999999999 111.449 177.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.19 -47.83 47.7 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.027 -0.533 . . . . 54.509999999999998 110.258 175.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 89.0 mt -61.4 -32.59 72.53 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.56 0.744 . . . . 63.119999999999997 110.807 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -59.31 -35.21 73.37 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.791 0.836 . . . . 63.240000000000002 110.827 173.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -83.79 -12.81 55.14 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 115.734 -0.666 . . . . 52.539999999999999 110.442 177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.8 mmt -98.87 0.65 44.62 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.793 0.837 . . . . 41.439999999999998 110.274 177.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 70.44 9.13 6.86 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 125.287 1.435 . . . . 75.519999999999996 112.309 -179.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -88.28 50.89 2.06 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.533 0.733 . . . . 72.209999999999994 110.521 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.91 -36.09 62.36 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.169 0.987 . . . . 73.239999999999995 111.687 175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -55.99 -36.85 68.35 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 124.714 1.259 . . . . 75.340000000000003 111.66 176.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.52 ' O ' HG23 ' A' ' 106' ' ' VAL . 10.6 mmpt? -87.94 -37.54 16.33 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.551 0.34 . . . . 62.130000000000003 110.573 179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.52 -41.54 85.69 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.12 0.888 . . . . 53.100000000000001 111.365 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 22.7 ptp -67.97 -25.62 65.52 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.063 0.545 . . . . 74.409999999999997 111.852 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -78.99 -23.17 44.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 122.28 0.232 . . . . 74.0 110.68 172.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 102' ' ' LYS . 59.6 t -80.86 -34.05 13.68 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 N-CA-C 109.201 -0.666 . . . . 73.450000000000003 109.201 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -49.23 78.01 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.671 1.188 . . . . 72.329999999999998 109.765 173.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -53.37 58.84 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.331 -1.304 . . . . 71.239999999999995 109.057 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.468 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.1 mmmt -65.75 -31.28 72.17 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.554 -0.748 . . . . 71.109999999999999 112.345 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.705 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -66.95 -44.13 81.4 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.405 0.441 . . . . 22.140000000000001 110.558 176.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 83.0 mt -64.42 -33.94 77.03 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 116.421 -0.354 . . . . 74.319999999999993 111.035 172.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.8 -25.32 63.72 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.55 0.74 . . . . 74.299999999999997 110.414 -178.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -75.67 -42.92 49.93 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.175 0.59 . . . . 72.219999999999999 110.144 172.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.473 ' HB3' HD13 ' A' ' 84' ' ' ILE . 22.1 t70 -166.33 132.21 2.4 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.528 0.731 . . . . 74.219999999999999 110.655 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 22.3 t -58.93 -39.79 82.65 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.172 0.989 . . . . 75.409999999999997 111.712 -177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 29.0 t -71.34 10.68 0.56 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 123.117 0.567 . . . . 61.509999999999998 111.402 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.705 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 17.4 t -83.12 15.33 2.89 Favored 'General case' 0 C--N 1.355 0.805 0 C-N-CA 123.093 0.557 . . . . 35.310000000000002 110.479 163.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.3 mmmt -40.34 -21.2 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.892 1.442 . . . . 62.32 114.892 169.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -50.38 -43.27 54.34 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 124.337 1.055 . . . . 65.120000000000005 111.539 171.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.95 -22.39 58.6 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.506 0.723 . . . . 33.439999999999998 111.28 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -77.45 -39.58 46.19 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.932 0.493 . . . . 64.219999999999999 110.273 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -69.28 -37.82 78.05 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.522 -0.763 . . . . 75.430000000000007 109.132 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -72.28 -27.72 69.39 Favored Glycine 0 C--N 1.354 1.535 0 CA-C-N 114.828 -1.078 . . . . 34.420000000000002 113.163 175.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -55.92 -52.84 62.7 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.676 0.791 . . . . 70.349999999999994 112.224 179.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -48.67 -37.82 19.56 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 124.225 0.953 . . . . 72.299999999999997 111.487 179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 25.5 ttt85 -71.47 -44.37 64.9 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.282 0.633 . . . . 75.409999999999997 111.347 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 78.2 m -63.91 -51.2 65.57 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.067 0.547 . . . . 72.25 111.159 -171.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.2 ptm -66.38 -41.74 88.97 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.854 -0.612 . . . . 72.129999999999995 111.579 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 15.9 ptt? -74.51 -19.1 60.49 Favored 'General case' 0 C--O 1.211 -0.936 0 CA-C-O 119.362 -0.351 . . . . 75.219999999999999 111.157 -179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -61.74 -22.5 65.43 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.237 0.615 . . . . 74.340000000000003 112.449 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -96.42 -31.62 12.75 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.285 0.634 . . . . 75.109999999999999 110.014 169.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 5.9 m-30 -92.89 37.05 1.02 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.031 0.533 . . . . 70.439999999999998 110.764 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.8 m120 . . . . . 0 C--O 1.252 1.202 0 N-CA-C 108.989 -0.745 . . . . 74.129999999999995 108.989 176.978 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 ttp . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 109.897 -0.409 . . . . 52.149999999999999 109.897 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.18 83.81 0.35 Allowed Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.462 -0.655 . . . . 73.450000000000003 111.462 177.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -72.52 93.8 1.61 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.046 0.538 . . . . 54.119999999999997 109.989 176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -67.43 110.87 3.78 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 108.45 -0.944 . . . . 74.040000000000006 108.45 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 35.2 p80 -119.59 26.79 9.15 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.845 0.458 . . . . 65.420000000000002 111.59 -174.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.0 p-80 -61.32 -24.03 66.14 Favored 'General case' 0 N--CA 1.487 1.419 0 CA-C-O 120.886 0.374 . . . . 64.040000000000006 110.974 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.2 t-80 -72.06 -40.0 68.65 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.681 1.192 . . . . 72.310000000000002 111.217 177.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -102.01 104.05 14.69 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.223 0.609 . . . . 75.150000000000006 109.651 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.2 m -54.66 100.77 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.658 1.183 . . . . 74.310000000000002 112.685 -175.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -148.01 74.86 1.32 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 106.187 -1.783 . . . . 70.319999999999993 106.187 178.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.479 ' HG3' HD22 ' A' ' 12' ' ' ASN . 21.5 ptp -55.38 -36.14 66.07 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.813 1.245 . . . . 65.25 113.804 -165.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.479 HD22 ' HG3' ' A' ' 11' ' ' MET . 37.2 m-80 -120.15 124.48 27.77 Favored Pre-proline 0 N--CA 1.476 0.832 0 N-CA-C 107.932 -1.136 . . . . 63.130000000000003 107.932 171.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.73 -44.81 44.25 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.362 2.041 . . . . 73.129999999999995 110.69 169.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.49 ' HB3' HD23 ' A' ' 17' ' ' LEU . 10.0 t70 -175.25 117.26 0.16 Allowed 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.35 1.06 . . . . 72.239999999999995 109.177 176.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.5 mp -57.96 -36.15 72.17 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.4 0.619 . . . . 72.299999999999997 110.749 178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.41 -21.0 66.5 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.345 -0.843 . . . . 72.430000000000007 112.819 -179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -80.5 -20.46 43.57 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 117.887 0.312 . . . . 62.43 110.444 179.188 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.7 mmt -73.5 -42.09 62.27 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 121.424 0.631 . . . . 70.129999999999995 110.263 -174.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.461 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -71.77 -31.58 41.97 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-N 115.154 -0.93 . . . . 75.5 112.232 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -73.24 -31.7 64.28 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 122.507 -0.12 . . . . 62.149999999999999 111.129 -177.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -67.66 -48.16 67.46 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.286 0.634 . . . . 75.010000000000005 111.158 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.525 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 17.8 ptmt -71.82 -24.0 61.64 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 123.525 0.516 . . . . 72.129999999999995 111.244 178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.1 -58.09 13.12 Favored Glycine 0 C--N 1.349 1.287 0 CA-C-N 116.271 -0.422 . . . . 62.119999999999997 112.843 171.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -60.79 -29.03 69.2 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.83 0.852 . . . . 61.130000000000003 111.765 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.525 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 3.2 tt0 -65.93 -47.47 74.62 Favored 'General case' 0 C--N 1.35 0.62 0 CA-C-O 118.948 -0.548 . . . . 73.209999999999994 110.084 174.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 93.6 m -56.34 -44.02 79.64 Favored 'General case' 0 N--CA 1.486 1.332 0 O-C-N 123.642 0.589 . . . . 63.009999999999998 111.719 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -58.32 -44.32 88.58 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.654 0.782 . . . . 72.010000000000005 110.275 175.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 23.4 tp60 -67.23 -20.97 65.76 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.806 -1.088 . . . . 51.530000000000001 111.088 177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.1 OUTLIER -80.1 0.45 31.98 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.627 -0.671 . . . . 62.539999999999999 109.916 176.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 92.08 2.98 68.21 Favored Glycine 0 C--N 1.356 1.668 0 O-C-N 123.469 0.48 . . . . 73.530000000000001 112.003 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -103.71 95.78 6.27 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.62 0.768 . . . . 52.310000000000002 109.181 -172.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -66.14 -49.76 54.17 Favored Pre-proline 0 CA--C 1.558 1.27 0 C-N-CA 124.169 0.988 . . . . 75.430000000000007 112.218 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -56.35 -53.47 5.25 Favored 'Trans proline' 0 C--N 1.4 3.271 0 C-N-CA 121.706 1.604 . . . . 70.540000000000006 113.12 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.99 -34.06 72.8 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.438 0.695 . . . . 72.420000000000002 111.572 -174.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.17 -46.89 82.4 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.097 -0.956 . . . . 52.340000000000003 110.897 173.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 26.0 mtm -68.57 -36.52 78.86 Favored 'General case' 0 N--CA 1.481 1.103 0 O-C-N 123.67 0.606 . . . . 64.140000000000001 109.833 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -61.96 -43.3 99.13 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.933 -1.031 . . . . 71.040000000000006 110.04 178.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 36.7 m80 -71.46 -25.26 62.22 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.44 -0.8 . . . . 75.209999999999994 112.24 175.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -75.92 -35.4 59.77 Favored 'General case' 0 N--CA 1.481 1.077 0 CA-C-N 117.837 0.29 . . . . 75.420000000000002 110.462 174.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.7 m -67.69 -42.26 82.33 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.042 0.537 . . . . 70.430000000000007 110.51 -178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 38' ' ' HIS . 13.2 pt-20 -75.78 -27.07 57.88 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.095 -0.502 . . . . 73.120000000000005 110.671 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.73 -27.21 66.6 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 122.566 0.346 . . . . 71.019999999999996 110.567 170.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.2 mp -68.37 -26.62 34.18 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.912 0.885 . . . . 70.109999999999999 110.515 175.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -78.69 -33.56 46.82 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 121.141 0.496 . . . . 73.109999999999999 109.877 177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG3' HG11 ' A' ' 19' ' ' VAL . 30.7 mmt180 -77.45 -53.57 7.48 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.536 1.134 . . . . 72.400000000000006 110.872 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -128.32 83.08 67.19 Favored Pre-proline 0 CA--C 1.556 1.176 0 C-N-CA 124.006 0.922 . . . . 71.310000000000002 111.023 177.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -75.78 5.74 4.18 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 123.009 2.473 . . . . 64.420000000000002 113.705 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -97.93 -30.79 12.53 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.282 0.633 . . . . 75.420000000000002 110.369 178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.469 ' HB3' HD23 ' A' ' 52' ' ' LEU . 7.1 m-20 -69.31 93.07 0.61 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.516 0.726 . . . . 62.039999999999999 112.468 -171.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.434 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -62.84 -20.0 64.65 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.956 1.303 . . . . 72.219999999999999 112.739 -176.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -71.9 -30.1 65.02 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.075 0.15 . . . . 71.340000000000003 111.279 177.087 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.469 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.3 mm? -63.95 -39.08 93.33 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 109.64 -0.504 . . . . 73.340000000000003 109.64 173.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -70.68 -52.16 22.9 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 124.412 1.085 . . . . 63.100000000000001 111.78 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.9 p -60.83 -34.03 73.95 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.659 0.384 . . . . 43.420000000000002 111.239 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -77.01 -34.99 57.36 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 124.508 1.123 . . . . 53.210000000000001 111.318 178.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.5 ttt180 -69.22 -48.46 61.94 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.089 0.956 . . . . 74.140000000000001 109.642 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 61' ' ' THR . . . -60.74 -36.34 78.65 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.807 1.243 . . . . 42.340000000000003 111.367 172.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.86 -31.44 72.67 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.16 0.584 . . . . 71.209999999999994 111.896 176.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 79.9 m -71.51 -47.48 55.11 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 109.728 -0.471 . . . . 62.229999999999997 109.728 171.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -56.44 -35.21 67.61 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.734 0.814 . . . . 62.329999999999998 112.827 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 57' ' ' ALA . 76.3 p -64.49 -36.4 84.05 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.529 0.332 . . . . 74.409999999999997 110.758 176.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -70.58 -29.53 65.99 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.353 0.597 . . . . 74.129999999999995 109.916 -177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.4 mt -90.18 5.73 45.72 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.924 -1.035 . . . . 72.519999999999996 110.923 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD13 ' HE1' ' A' ' 66' ' ' PHE . 4.0 mm? 67.96 11.54 8.41 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 125.0 1.32 . . . . 61.100000000000001 112.851 176.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -92.95 54.75 2.23 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 124.811 1.245 . . . . 74.450000000000003 110.232 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.405 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.3 m-85 -61.04 -20.43 62.54 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.969 0.908 . . . . 71.519999999999996 111.1 177.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -54.71 -43.33 72.48 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.713 0.805 . . . . 72.129999999999995 110.426 172.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.1 mt -76.36 -38.15 56.26 Favored 'General case' 0 C--N 1.349 0.58 0 CA-C-N 115.12 -0.946 . . . . 63.299999999999997 109.218 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.93 -29.94 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.735 0.814 . . . . 72.430000000000007 112.157 -177.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.7 mt -65.8 -65.16 0.71 Allowed 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.83 0.452 . . . . 72.25 110.498 174.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.59 -29.54 70.78 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.596 0.758 . . . . 63.109999999999999 112.784 -174.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -70.55 -33.59 71.31 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.518 0.727 . . . . 72.140000000000001 110.208 176.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.627 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 42.2 t -81.08 -28.03 35.43 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.267 0.627 . . . . 63.32 111.273 175.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -66.99 -30.54 70.68 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.693 0.397 . . . . 71.340000000000003 111.532 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -86.12 -36.75 19.4 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 122.445 0.298 . . . . 35.409999999999997 110.729 172.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.434 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.6 t -54.35 -38.88 66.55 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.817 0.847 . . . . 74.230000000000004 112.294 178.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.18 21.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-N 115.621 -0.718 . . . . 74.540000000000006 110.177 -178.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -73.76 -31.21 63.2 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.524 0.678 . . . . 75.030000000000001 109.655 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.98 -47.72 17.87 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 114.608 -1.178 . . . . 74.209999999999994 110.389 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -143.91 99.17 5.14 Favored Pre-proline 0 CA--C 1.554 1.099 0 CA-C-N 115.661 -0.7 . . . . 63.43 110.287 179.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.74 -3.54 12.44 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.187 2.591 . . . . 73.239999999999995 115.045 178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.9 p -110.01 17.85 20.66 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 118.653 0.66 . . . . 72.420000000000002 111.336 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' CE2' ' HB2' ' A' ' 85' ' ' LYS . 10.8 t80 -84.78 107.42 16.95 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 122.935 0.494 . . . . 74.0 110.547 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.45 HG23 ' SG ' ' A' ' 117' ' ' CYS . 73.3 mt -57.62 -46.05 86.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.484 1.113 . . . . 73.209999999999994 111.698 -177.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.463 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.9 mmpt? -65.41 -25.79 67.69 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 123.65 0.593 . . . . 74.329999999999998 111.552 -175.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -70.6 -40.34 66.82 Favored Glycine 0 C--N 1.352 1.451 0 N-CA-C 112.075 -0.41 . . . . 54.100000000000001 112.075 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 -72.8 -36.0 67.48 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.928 0.891 . . . . 65.329999999999998 112.279 -178.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 38.5 p -69.18 -32.42 71.72 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.987 0.515 . . . . 74.230000000000004 111.238 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 26.8 mmt180 -76.48 -41.6 46.59 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.915 0.486 . . . . 74.109999999999999 110.878 174.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.627 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 22.6 tptm -62.29 -49.61 74.99 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.708 0.803 . . . . 62.439999999999998 111.397 -176.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.482 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.05 -34.54 77.9 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.346 0.658 . . . . 73.25 111.697 -177.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.84 -36.27 81.96 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.058 0.543 . . . . 54.420000000000002 111.003 175.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.14 66.17 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.82 -0.627 . . . . 54.439999999999998 110.591 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.04 -39.7 86.85 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.659 0.783 . . . . 52.329999999999998 110.993 177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -61.9 -28.36 69.46 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 123.643 0.777 . . . . 72.420000000000002 110.684 175.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.46 -16.36 52.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.758 0.423 . . . . 72.200000000000003 110.527 177.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.7 mmt -96.54 4.8 51.8 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.57 0.748 . . . . 72.310000000000002 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 70.55 12.13 7.36 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.72 1.208 . . . . 73.510000000000005 111.714 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.43 41.36 0.83 Allowed 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.487 1.115 . . . . 63.219999999999999 110.77 178.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 19.0 m-85 -48.46 -35.82 13.73 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.759 1.223 . . . . 71.409999999999997 112.436 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 64.0 p -59.28 -43.83 92.52 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.507 -1.224 . . . . 61.140000000000001 111.579 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 106' ' ' VAL . 7.5 mmpt? -89.34 -29.48 19.1 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.942 0.497 . . . . 62.020000000000003 111.3 -178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.76 -45.66 91.66 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 123.578 0.751 . . . . 75.400000000000006 110.246 178.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.4 ' HB2' ' CE1' ' A' ' 124' ' ' TYR . 17.2 ptp -62.14 -28.22 69.49 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 123.868 0.73 . . . . 52.439999999999998 112.061 -179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 70.4 m-20 -66.86 -39.99 87.73 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 123.555 0.534 . . . . 60.420000000000002 109.924 172.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.482 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 47.4 t -79.78 -27.83 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 C-N-CA 123.017 0.527 . . . . 70.230000000000004 110.15 -174.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -67.68 -44.3 78.12 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.57 0.748 . . . . 74.209999999999994 109.378 171.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -49.59 76.97 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.38 1.072 . . . . 73.5 109.121 177.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.6 mmmt -65.5 -36.26 83.32 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 123.91 0.756 . . . . 70.549999999999997 111.476 -178.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.665 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.44 -45.3 94.87 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 123.145 0.578 . . . . 74.219999999999999 110.608 174.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 79.9 mt -65.63 -32.93 74.77 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.691 0.796 . . . . 74.109999999999999 111.338 174.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -71.28 -24.26 62.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.05 1.34 . . . . 64.209999999999994 110.659 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.5 mt -74.02 -47.77 34.71 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 122.784 0.434 . . . . 62.350000000000001 109.98 175.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -164.81 147.81 8.58 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-O 121.054 0.454 . . . . 72.340000000000003 111.7 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.2 p -58.29 -36.29 73.08 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.06 1.344 . . . . 64.310000000000002 112.041 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 92.0 p -60.42 -11.08 5.8 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.355 0.662 . . . . 72.219999999999999 112.495 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.665 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 43.6 t -79.55 15.81 1.22 Allowed 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.398 0.679 . . . . 63.329999999999998 112.353 174.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -41.37 -25.81 0.05 OUTLIER 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 115.132 1.53 . . . . 61.049999999999997 115.132 172.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -51.61 -36.88 47.57 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.259 1.024 . . . . 73.230000000000004 112.529 172.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -78.84 -17.89 54.93 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.382 1.073 . . . . 74.040000000000006 111.708 176.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -74.71 -39.51 61.87 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.075 -0.713 . . . . 63.130000000000003 109.075 172.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 11.5 m-20 -59.69 -44.75 93.53 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.413 -0.588 . . . . 63.109999999999999 109.413 170.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -63.78 -32.66 84.91 Favored Glycine 0 C--N 1.35 1.328 0 CA-C-N 114.582 -1.19 . . . . 32.0 113.111 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CE1' ' HB2' ' A' ' 104' ' ' MET . 33.4 t80 -68.42 -54.46 16.92 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.202 0.501 . . . . 74.400000000000006 111.173 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.23 -43.35 42.58 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.837 0.855 . . . . 74.420000000000002 112.527 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 8.3 ptm85 -77.02 -22.78 52.53 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 112.618 0.599 . . . . 73.310000000000002 112.618 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.402 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -78.96 -52.34 8.4 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.444 0.698 . . . . 74.129999999999995 111.077 -177.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.1 ptm -62.15 -40.98 97.8 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 115.624 -0.716 . . . . 54.229999999999997 110.928 177.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -68.5 -30.59 69.45 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 122.151 0.18 . . . . 60.130000000000003 110.763 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.11 -25.59 68.43 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.536 0.735 . . . . 62.350000000000001 112.733 -174.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.414 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 15.9 pt20 -95.12 -25.31 16.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.591 0.356 . . . . 70.040000000000006 111.394 170.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.7 m-30 -99.83 36.89 1.71 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.834 0.454 . . . . 70.109999999999999 110.219 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.2 m120 . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 108.921 -0.77 . . . . 74.5 108.921 177.448 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.2 ttp . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.614 0.245 . . . . 61.210000000000001 110.645 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.42 53.3 4.78 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 116.564 -0.289 . . . . 72.25 113.111 -178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -75.19 89.65 2.53 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 107.828 -1.175 . . . . 71.140000000000001 107.828 171.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -60.21 -63.89 1.14 Allowed 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.92 0.888 . . . . 71.129999999999995 111.297 -170.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -166.54 126.68 1.61 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 108.606 -0.887 . . . . 75.549999999999997 108.606 178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -64.5 91.73 0.08 Allowed 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 109.704 -0.48 . . . . 71.430000000000007 109.704 178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -76.35 115.17 15.83 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.6 0.76 . . . . 60.399999999999999 109.411 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -60.84 117.75 5.81 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 124.122 0.889 . . . . 72.140000000000001 109.855 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 p -78.41 -168.31 1.31 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.969 0.908 . . . . 73.019999999999996 110.204 175.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 56.7 m170 -76.31 -171.5 1.79 Allowed 'General case' 0 N--CA 1.478 0.956 0 O-C-N 121.971 -0.456 . . . . 72.420000000000002 110.094 172.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 78.9 mtp -62.85 -21.78 66.21 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 111.844 0.313 . . . . 71.530000000000001 111.844 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.82 121.82 79.47 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 108.069 -1.086 . . . . 75.450000000000003 108.069 163.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -47.63 -36.5 25.16 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 123.91 3.073 . . . . 31.43 113.687 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.517 ' HB3' HD23 ' A' ' 17' ' ' LEU . 21.4 t0 -165.43 114.2 1.02 Allowed 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.069 -0.969 . . . . 73.209999999999994 109.206 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.424 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.9 mp -60.37 -32.99 71.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.233 0.613 . . . . 65.319999999999993 110.434 177.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.75 -23.43 67.19 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.981 -1.009 . . . . 70.150000000000006 112.599 176.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.643 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -79.62 -23.21 42.79 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 110.103 -0.332 . . . . 75.439999999999998 110.103 178.651 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -74.31 -35.15 63.67 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-O 121.259 0.552 . . . . 74.120000000000005 110.863 -174.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.609 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.6 p -76.6 -29.18 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 CA-C-N 115.186 -0.915 . . . . 71.129999999999995 112.006 -176.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.643 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.0 ptpt -73.58 -30.94 63.33 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 121.609 -0.682 . . . . 74.519999999999996 110.25 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.431 HD21 HD12 ' A' ' 17' ' ' LEU . 90.5 m-20 -59.33 -51.18 71.05 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.198 0.999 . . . . 73.230000000000004 111.276 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -27.84 68.0 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 115.527 -0.76 . . . . 74.140000000000001 111.151 176.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.93 -41.3 98.73 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.484 0.49 . . . . 64.230000000000004 112.747 172.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 58.8 m-80 -66.68 -40.81 88.69 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.504 0.721 . . . . 74.420000000000002 111.118 174.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -67.78 -33.84 75.61 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 116.285 -0.416 . . . . 50.049999999999997 110.233 -176.755 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 76.2 m -58.36 -45.86 87.4 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.143 0.423 . . . . 72.510000000000005 112.143 174.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -55.83 -43.55 77.1 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.812 0.695 . . . . 75.519999999999996 110.491 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.89 -25.59 68.22 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 114.285 -1.325 . . . . 74.230000000000004 111.858 177.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.8 mmmt -75.53 -18.48 59.78 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 122.219 -0.301 . . . . 73.230000000000004 110.321 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.56 2.04 24.38 Favored Glycine 0 C--N 1.351 1.388 0 CA-C-N 116.043 -0.526 . . . . 63.310000000000002 112.119 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.714 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 14.1 m-20 -83.69 82.17 8.43 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.299 -0.63 . . . . 71.310000000000002 109.299 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -70.34 -48.5 18.48 Favored Pre-proline 0 CA--C 1.558 1.255 0 C-N-CA 123.296 0.638 . . . . 74.010000000000005 112.307 177.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -68.47 -51.8 0.51 Allowed 'Trans proline' 0 C--N 1.389 2.667 0 C-N-CA 121.251 1.301 . . . . 73.319999999999993 111.835 176.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.714 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.5 mm-40 -60.22 -30.83 69.64 Favored 'General case' 0 C--N 1.351 0.653 0 CA-C-N 115.209 -0.905 . . . . 73.549999999999997 111.362 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.12 -41.35 68.25 Favored 'General case' 0 C--N 1.36 1.046 0 O-C-N 123.745 0.653 . . . . 62.240000000000002 111.2 176.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.2 mtm -68.03 -36.65 80.27 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.881 0.738 . . . . 72.019999999999996 109.644 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -71.16 -31.27 67.49 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 115.326 -0.852 . . . . 73.200000000000003 110.393 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 58.4 m-70 -78.88 -20.09 50.34 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.754 0.822 . . . . 71.540000000000006 110.554 175.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -80.31 -23.58 40.56 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.807 0.443 . . . . 70.0 110.615 167.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 25.9 m -69.33 -47.25 64.98 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.006 0.523 . . . . 74.129999999999995 110.683 179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.47 -27.01 68.83 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.812 0.695 . . . . 62.439999999999998 110.594 176.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.39 -42.63 61.88 Favored 'General case' 0 C--N 1.354 0.771 0 O-C-N 123.964 0.79 . . . . 62.43 111.381 174.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.631 HD12 HH21 ' A' ' 56' ' ' ARG . 64.9 mt -64.11 -31.66 54.24 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 124.144 0.978 . . . . 62.240000000000002 111.152 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.9 mmtp -58.71 -29.94 67.06 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.004 0.43 . . . . 52.009999999999998 111.087 174.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.609 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmt180 -88.87 -47.21 8.33 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.299 -0.864 . . . . 51.399999999999999 109.853 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.52 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 1.1 p-10 -124.64 82.69 59.27 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.348 1.059 . . . . 73.530000000000001 110.802 -176.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -80.36 -12.19 12.88 Favored 'Trans proline' 0 C--N 1.378 2.117 0 C-N-CA 122.698 2.265 . . . . 74.420000000000002 112.678 178.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -84.7 -10.17 57.53 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.794 0.838 . . . . 70.439999999999998 111.899 176.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.52 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 9.3 t70 -86.38 89.18 7.79 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.684 0.793 . . . . 75.209999999999994 109.223 -171.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -66.02 -40.26 90.91 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.239 1.016 . . . . 64.209999999999994 113.698 -169.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HE2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -63.66 -22.0 66.67 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 122.907 0.483 . . . . 75.219999999999999 111.707 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -68.08 -37.79 81.62 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.682 0.793 . . . . 73.120000000000005 110.01 177.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 56' ' ' ARG . 96.7 m-85 -68.41 -36.68 79.46 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.215 -0.902 . . . . 74.409999999999997 110.227 173.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.0 m -72.37 -27.9 62.68 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.467 0.707 . . . . 73.019999999999996 112.279 -178.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -66.12 -34.16 77.43 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.108 0.563 . . . . 74.099999999999994 109.983 173.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.631 HH21 HD12 ' A' ' 43' ' ' ILE . 54.1 ttm-85 -68.87 -42.82 76.49 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.862 -1.063 . . . . 74.140000000000001 110.239 176.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.52 -31.71 72.92 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.587 0.755 . . . . 65.430000000000007 111.22 176.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB1' ' HD2' ' A' ' 89' ' ' ARG . . . -65.45 -33.6 76.33 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.233 -0.894 . . . . 75.340000000000003 110.93 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 58.4 m -78.38 -37.55 43.91 Favored 'General case' 0 CA--C 1.55 0.962 0 CA-C-N 115.95 -0.568 . . . . 63.140000000000001 110.386 173.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -57.83 -34.26 69.51 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.77 0.828 . . . . 74.510000000000005 112.497 -177.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.3 p -57.03 -41.83 79.32 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-O 121.076 0.465 . . . . 71.230000000000004 110.892 175.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? -70.32 -27.78 64.64 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.148 -0.933 . . . . 75.510000000000005 110.282 -175.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.7 mt -96.43 10.78 37.14 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.241 1.016 . . . . 53.520000000000003 111.049 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 66.5 9.81 6.83 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.071 0.948 . . . . 72.209999999999994 112.646 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -84.7 44.71 1.08 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.611 1.164 . . . . 75.420000000000002 111.785 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.458 ' CD1' ' HA ' ' A' ' 93' ' ' ALA . 98.6 m-85 -60.7 -27.55 67.96 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 123.578 0.751 . . . . 75.540000000000006 111.871 -177.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -56.68 -40.63 75.89 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.491 0.716 . . . . 73.310000000000002 110.872 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 43.2 mt -77.19 -28.91 54.13 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.403 -0.817 . . . . 73.340000000000003 109.81 -177.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.86 73.76 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.506 0.722 . . . . 43.119999999999997 111.588 175.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 52.5 mt -68.61 -52.63 29.4 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.869 0.468 . . . . 73.549999999999997 111.413 176.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 17.3 ptpt -66.08 -28.06 68.55 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 115.786 -0.643 . . . . 53.450000000000003 110.602 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -61.82 -45.32 94.32 Favored 'General case' 0 C--O 1.211 -0.946 0 O-C-N 123.871 0.732 . . . . 73.430000000000007 110.605 169.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.414 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 42.4 t -59.61 -52.14 66.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.028 0.531 . . . . 71.530000000000001 111.409 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 11.8 pt-20 -69.14 -22.5 63.95 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 112.755 0.65 . . . . 64.340000000000003 112.755 -174.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -88.6 -42.0 12.31 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 118.5 0.591 . . . . 74.150000000000006 110.757 173.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.642 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 53.3 t -65.87 -28.6 69.08 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.486 0.715 . . . . 70.120000000000005 111.583 -175.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.696 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.13 -26.94 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 123.223 0.609 . . . . 60.439999999999998 110.448 176.936 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.451 HE21 HG23 ' A' ' 77' ' ' ILE . 22.8 mm-40 -72.83 -40.53 65.68 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 122.9 0.48 . . . . 75.340000000000003 110.676 -179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 70.7 mt -82.96 -57.58 3.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.597 0.359 . . . . 71.25 110.839 -178.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.61 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 30.8 tt0 -151.78 105.62 2.86 Favored Pre-proline 0 CA--C 1.544 0.73 0 C-N-CA 123.759 0.824 . . . . 74.099999999999994 109.911 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.696 ' HB3' HG12 ' A' ' 77' ' ' ILE . 86.0 Cg_endo -80.6 -8.86 13.58 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 122.354 2.036 . . . . 74.209999999999994 112.656 170.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 82.2 p -85.83 17.17 3.55 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.807 0.669 . . . . 73.109999999999999 112.807 -173.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -73.9 119.59 18.32 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.215 -0.661 . . . . 74.239999999999995 109.215 170.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.3 mt -89.06 -49.07 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 122.892 0.477 . . . . 55.329999999999998 110.839 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -78.32 85.79 4.43 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 122.4 1.095 . . . . 72.140000000000001 109.362 -177.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 157.84 -32.87 0.52 Allowed Glycine 0 C--N 1.336 0.563 0 CA-C-N 113.17 -1.832 . . . . 65.530000000000001 109.686 -173.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -59.52 -52.53 65.19 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.911 1.284 . . . . 60.039999999999999 112.575 -177.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 32.8 m -59.35 -38.43 80.39 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.065 0.546 . . . . 74.200000000000003 111.941 -175.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.402 ' HD2' ' HB1' ' A' ' 58' ' ' ALA . 90.8 mtt-85 -75.63 -27.52 58.44 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.484 0.714 . . . . 63.310000000000002 111.101 179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.414 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 28.5 ttmt -81.84 -25.13 35.4 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.454 1.102 . . . . 74.030000000000001 110.737 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -70.49 -35.34 73.19 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.083 -0.71 . . . . 64.549999999999997 109.083 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.72 -26.23 63.3 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.193 -0.912 . . . . 71.239999999999995 110.933 173.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.458 ' HA ' ' CD1' ' A' ' 66' ' ' PHE . . . -67.46 -50.33 59.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.658 -0.497 . . . . 54.240000000000002 109.658 171.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.12 -33.43 73.37 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.323 -0.853 . . . . 71.540000000000006 111.881 177.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -54.8 -39.03 68.04 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.534 0.733 . . . . 64.099999999999994 110.935 171.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.15 -23.15 61.25 Favored 'General case' 0 C--N 1.353 0.754 0 C-N-CA 123.129 0.572 . . . . 63.100000000000001 110.314 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 16.8 mmt -93.74 3.37 55.55 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.877 0.871 . . . . 71.319999999999993 110.04 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.64 13.32 9.28 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.481 1.512 . . . . 73.530000000000001 111.008 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.428 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 79.0 m-20 -89.7 54.44 2.87 Favored 'General case' 0 C--N 1.349 0.547 0 C-N-CA 124.451 1.101 . . . . 62.310000000000002 110.282 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -55.58 -35.51 65.86 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.821 0.849 . . . . 72.329999999999998 110.739 175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.7 p -60.12 -38.94 84.56 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 113.675 -1.602 . . . . 73.319999999999993 111.281 175.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 10.1 mmpt? -87.07 -22.17 25.6 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 122.312 0.245 . . . . 64.400000000000006 110.624 -178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -44.56 80.57 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.885 0.741 . . . . 33.539999999999999 109.536 175.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.475 ' HA ' ' HB3' ' A' ' 107' ' ' TYR . 18.1 ptp -70.33 -23.1 62.77 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 116.167 -0.47 . . . . 63.439999999999998 111.914 178.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.47 -36.41 83.79 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 109.776 -0.453 . . . . 71.420000000000002 109.776 167.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 102' ' ' LYS . 76.4 t -75.16 -34.26 30.94 Favored 'Isoleucine or valine' 0 C--N 1.353 0.722 0 N-CA-C 109.604 -0.517 . . . . 44.539999999999999 109.604 -178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.475 ' HB3' ' HA ' ' A' ' 104' ' ' MET . 1.2 t80 -60.29 -51.48 69.38 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.545 1.138 . . . . 73.049999999999997 110.717 173.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.13 -52.64 64.04 Favored 'General case' 0 C--N 1.35 0.592 0 CA-C-N 114.998 -1.001 . . . . 75.510000000000005 108.666 -176.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.565 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 29.4 mmmt -58.28 -37.15 74.42 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 115.062 -0.972 . . . . 72.530000000000001 112.394 176.501 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.564 ' HB1' ' HB2' ' A' ' 117' ' ' CYS . . . -61.35 -49.26 77.67 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 123.464 0.477 . . . . 71.519999999999996 110.459 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.711 HD23 ' SG ' ' A' ' 117' ' ' CYS . 88.4 mt -63.87 -34.33 77.69 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.51 0.506 . . . . 72.409999999999997 110.912 176.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -64.31 -27.6 69.14 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.743 0.817 . . . . 71.209999999999994 111.253 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 74.9 mt -76.18 -71.07 0.41 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.064 0.545 . . . . 62.439999999999998 110.008 175.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -165.9 149.63 7.86 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.013 0.525 . . . . 73.329999999999998 111.492 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.557 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 16.9 p -56.88 -15.25 4.45 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 125.75 1.62 . . . . 72.329999999999998 114.453 -174.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 50.6 m -65.71 -0.57 2.2 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 118.377 0.535 . . . . 62.520000000000003 111.829 173.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.711 ' SG ' HD23 ' A' ' 111' ' ' LEU . 31.7 p -93.85 12.79 24.65 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.738 1.215 . . . . 62.32 112.932 171.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 115' ' ' SER . 12.6 mmmm -48.26 -31.71 6.27 Favored 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 119.537 1.062 . . . . 73.019999999999996 113.157 177.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -51.56 -39.97 58.85 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.581 1.152 . . . . 73.319999999999993 112.427 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.92 -29.1 69.47 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.514 0.726 . . . . 62.200000000000003 111.631 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.04 -44.46 92.44 Favored 'General case' 0 C--N 1.361 1.086 0 O-C-N 123.2 0.312 . . . . 65.340000000000003 110.424 176.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -63.48 -39.24 93.94 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 123.512 0.508 . . . . 72.519999999999996 110.181 175.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.18 -27.85 73.58 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.322 -0.854 . . . . 61.140000000000001 113.35 178.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -60.98 -47.93 84.15 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.288 0.635 . . . . 73.310000000000002 111.689 176.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -49.7 -38.81 34.63 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 124.039 0.837 . . . . 75.209999999999994 111.316 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -65.27 -45.53 84.13 Favored 'General case' 0 CA--C 1.552 1.029 0 O-C-N 123.862 0.726 . . . . 74.310000000000002 111.297 173.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 62.9 m -66.24 -56.11 12.87 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.506 0.504 . . . . 64.219999999999999 110.874 -172.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 18.1 ptm -58.97 -43.54 91.38 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 115.732 -0.667 . . . . 72.129999999999995 111.887 -178.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.3 ptm -74.34 -30.9 62.23 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-O 119.378 -0.344 . . . . 73.140000000000001 111.739 -173.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.13 -43.76 91.99 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.544 0.738 . . . . 75.319999999999993 112.274 -172.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -74.3 -30.83 62.26 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 115.399 -0.819 . . . . 71.510000000000005 110.904 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 15.6 m-30 -94.67 38.73 1.1 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 122.991 0.516 . . . . 75.5 111.107 -176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 118.657 -0.687 . . . . 61.229999999999997 109.237 174.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 108.875 -0.787 . . . . 63.399999999999999 108.875 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -66.72 -76.4 0.37 Allowed Glycine 0 C--N 1.352 1.432 0 O-C-N 123.586 0.554 . . . . 53.109999999999999 112.975 -175.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 63.31 22.55 13.37 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 124.272 1.029 . . . . 75.239999999999995 111.929 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -88.77 -21.02 24.02 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.925 0.89 . . . . 71.140000000000001 109.982 178.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -96.63 113.74 25.33 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.641 0.776 . . . . 73.400000000000006 109.76 178.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -125.88 116.86 22.2 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.463 0.705 . . . . 60.020000000000003 110.666 176.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -123.73 4.71 8.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.851 0.861 . . . . 74.239999999999995 110.788 173.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -132.95 120.94 22.09 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.95 0.9 . . . . 75.010000000000005 108.841 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.403 ' OG ' ' HA ' ' A' ' 13' ' ' PRO . 13.6 t -166.2 174.93 8.75 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 123.912 0.757 . . . . 61.32 110.848 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 p-80 -112.04 -175.92 2.8 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.938 1.295 . . . . 71.319999999999993 109.795 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -50.99 -40.61 58.39 Favored 'General case' 0 N--CA 1.503 2.198 0 C-N-CA 124.014 0.926 . . . . 70.310000000000002 112.942 -171.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -104.71 99.92 20.82 Favored Pre-proline 0 CA--C 1.537 0.48 0 N-CA-C 107.92 -1.141 . . . . 75.209999999999994 107.92 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 36.1 Cg_exo -60.13 -36.31 89.3 Favored 'Trans proline' 0 C--N 1.378 2.106 0 C-N-CA 122.738 2.292 . . . . 61.210000000000001 113.425 -172.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.513 ' HB3' HD23 ' A' ' 17' ' ' LEU . 12.0 t70 -161.33 124.94 3.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.944 0.777 . . . . 74.25 110.154 -176.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.9 mp -61.98 -33.35 74.15 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.335 0.654 . . . . 62.43 110.837 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.04 -21.06 66.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.797 0.839 . . . . 55.109999999999999 112.141 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.68 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -81.88 -19.3 41.18 Favored 'General case' 0 C--N 1.359 1.02 0 N-CA-C 110.202 -0.296 . . . . 62.140000000000001 110.202 177.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -75.59 -35.32 60.59 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.696 0.399 . . . . 74.319999999999993 110.768 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.528 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.8 p -77.84 -31.95 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 C-N-CA 123.143 0.577 . . . . 72.150000000000006 111.44 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.1 ptpt -72.62 -24.29 61.05 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 119.509 -0.281 . . . . 71.420000000000002 110.529 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.411 ' HA ' ' ND2' ' A' ' 24' ' ' ASN . 95.3 m-20 -64.99 -54.62 27.62 Favored 'General case' 0 C--N 1.358 0.958 0 O-C-N 123.918 0.761 . . . . 55.210000000000001 110.602 178.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -68.84 -29.61 67.97 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 123.796 0.685 . . . . 53.5 110.667 178.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.09 -52.32 53.16 Favored Glycine 0 C--N 1.349 1.261 0 CA-C-N 115.938 -0.574 . . . . 34.340000000000003 113.085 171.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 6.8 p30 -77.51 -22.64 50.88 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 122.865 0.466 . . . . 64.150000000000006 111.881 -179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.508 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.4 pt-20 -70.89 -40.47 72.18 Favored 'General case' 0 C--N 1.358 0.969 0 N-CA-C 108.512 -0.922 . . . . 74.319999999999993 108.512 176.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.4 m -64.48 -41.89 96.2 Favored 'General case' 0 C--N 1.364 1.238 0 O-C-N 123.781 0.676 . . . . 51.200000000000003 111.12 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -58.87 -43.42 90.88 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 121.165 0.507 . . . . 64.519999999999996 110.253 173.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.95 -21.14 66.78 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 124.813 1.245 . . . . 64.340000000000003 111.591 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -77.45 -12.28 59.94 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.905 -0.497 . . . . 75.319999999999993 110.481 177.442 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.71 19.48 12.04 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.511 0.507 . . . . 53.43 112.366 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -94.58 148.2 22.5 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 108.8 -0.815 . . . . 70.519999999999996 108.8 173.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.624 ' H ' ' HD2' ' A' ' 33' ' ' PRO . 93.9 m-85 -127.51 -53.11 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.168 0 CA-C-O 118.439 -0.791 . . . . 74.340000000000003 112.097 -175.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.624 ' HD2' ' H ' ' A' ' 32' ' ' TYR . 55.3 Cg_endo -68.65 -59.3 0.1 OUTLIER 'Trans proline' 0 C--N 1.395 3.01 0 C-N-CA 121.49 1.46 . . . . 61.130000000000003 111.666 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.0 mm-40 -63.02 -33.22 74.96 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 122.992 0.517 . . . . 74.219999999999999 110.367 -176.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.44 -38.66 81.29 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.929 0.892 . . . . 63.32 110.795 176.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 34.8 ttp -70.56 -32.53 69.97 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.435 -0.802 . . . . 75.329999999999998 109.757 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -73.52 -35.29 65.57 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.012 0.925 . . . . 64.510000000000005 110.467 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -69.61 -23.59 63.53 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.158 0.583 . . . . 74.400000000000006 110.589 175.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.416 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 22.4 m-85 -78.33 -35.13 48.01 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 122.968 0.507 . . . . 75.25 111.132 169.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 27.1 m -62.47 -48.18 80.76 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.581 0.352 . . . . 64.409999999999997 110.283 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.68 -29.47 69.48 Favored 'General case' 0 C--N 1.354 0.782 0 O-C-N 123.779 0.675 . . . . 74.140000000000001 111.197 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 52' ' ' LEU . . . -70.7 -33.83 71.3 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 122.795 0.438 . . . . 72.450000000000003 110.629 176.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.507 HG13 HD12 ' A' ' 52' ' ' LEU . 97.0 mt -70.77 -31.21 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.573 0.749 . . . . 65.430000000000007 110.09 173.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' THR . 73.8 mmtt -68.28 -17.97 64.41 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.546 0.338 . . . . 73.409999999999997 110.745 174.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' HG3' HG11 ' A' ' 19' ' ' VAL . 41.1 mmt180 -91.29 -41.99 10.63 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.663 0.785 . . . . 74.409999999999997 110.479 172.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.418 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -135.19 83.23 39.47 Favored Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 123.432 0.693 . . . . 63.140000000000001 111.922 -178.185 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.73 -3.89 14.32 Favored 'Trans proline' 0 C--N 1.375 1.923 0 C-N-CA 122.444 2.096 . . . . 75.219999999999999 112.98 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HA ' HD13 ' A' ' 79' ' ' LEU . 69.9 mmtt -99.88 -0.83 38.83 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.314 0.646 . . . . 70.150000000000006 110.527 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -90.85 102.37 15.13 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.906 0.882 . . . . 44.109999999999999 109.805 -173.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . . . -63.34 -49.07 75.37 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.486 0.921 . . . . 74.099999999999994 113.486 -172.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -60.32 -21.43 62.02 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.768 -0.651 . . . . 63.140000000000001 112.055 -177.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.507 HD12 HG13 ' A' ' 43' ' ' ILE . 0.2 OUTLIER -67.15 -39.94 86.6 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.863 0.465 . . . . 44.119999999999997 110.999 177.165 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -67.26 -35.23 79.09 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 109.671 -0.492 . . . . 75.219999999999999 109.671 173.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 10.2 t -78.87 -18.93 53.14 Favored 'General case' 0 CA--C 1.554 1.123 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.73 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -76.04 -41.63 50.18 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.528 0.731 . . . . 63.210000000000001 110.163 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.5 ptt180 -74.32 -24.85 59.27 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.818 -0.438 . . . . 73.150000000000006 109.818 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.485 ' HB3' ' HA ' ' A' ' 54' ' ' SER . . . -69.17 -33.81 73.96 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.38 0.672 . . . . 63.420000000000002 110.724 171.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.25 -24.24 65.78 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.181 0.592 . . . . 71.340000000000003 110.44 173.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 38.2 m -75.18 -48.96 21.05 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 109.918 -0.401 . . . . 74.209999999999994 109.918 168.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -57.93 -35.12 70.64 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.949 0.9 . . . . 72.219999999999999 112.569 -175.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 37.9 p -59.97 -43.97 94.76 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-O 121.175 0.512 . . . . 53.210000000000001 110.087 172.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -71.3 -26.13 62.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.981 0.912 . . . . 71.400000000000006 110.799 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.526 HD21 ' HB3' ' A' ' 32' ' ' TYR . 89.1 mt -92.85 6.83 46.29 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.076 0.951 . . . . 72.5 110.87 178.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.407 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 66.92 10.92 8.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.188 0.995 . . . . 63.210000000000001 112.376 177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -94.26 46.48 1.16 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.744 1.218 . . . . 73.019999999999996 109.605 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 65.4 m-85 -52.16 -32.62 36.71 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 124.447 1.099 . . . . 65.219999999999999 112.031 -179.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -56.15 -38.81 71.36 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.683 0.793 . . . . 71.329999999999998 111.236 177.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 20.6 mt -74.97 -40.35 60.77 Favored 'General case' 0 C--N 1.348 0.506 0 CA-C-N 115.582 -0.736 . . . . 64.310000000000002 109.382 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.42 -35.6 77.98 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.351 1.06 . . . . 70.340000000000003 112.512 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 98.1 mt -70.75 -57.46 4.63 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-N 115.83 -0.623 . . . . 72.340000000000003 109.798 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -62.92 -25.25 68.24 Favored 'General case' 0 N--CA 1.482 1.129 0 O-C-N 123.813 0.696 . . . . 71.230000000000004 111.773 -177.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.45 -47.53 85.27 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.647 0.779 . . . . 74.230000000000004 110.877 174.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.668 ' HA ' ' SG ' ' A' ' 76' ' ' CYS . 50.5 t -74.68 -29.59 61.27 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.012 -0.54 . . . . 70.109999999999999 111.15 177.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 16.9 mm-40 -68.71 -30.87 69.61 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.164 0.586 . . . . 64.109999999999999 111.897 179.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -87.5 -45.68 10.27 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 120.918 0.39 . . . . 63.420000000000002 111.138 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.668 ' SG ' ' HA ' ' A' ' 73' ' ' CYS . 20.6 p -69.25 -27.83 65.78 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 116.223 -0.444 . . . . 71.349999999999994 112.059 -170.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -62.15 -23.14 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.244 0 C-N-CA 124.175 0.99 . . . . 74.150000000000006 110.245 176.284 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 64.5 mm-40 -74.03 -25.86 60.1 Favored 'General case' 0 C--N 1.359 1.007 0 C-N-CA 122.758 0.423 . . . . 73.219999999999999 110.54 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 48' ' ' LYS . 81.8 mt -86.48 -47.13 9.55 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.704 0.802 . . . . 73.209999999999994 110.414 176.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.577 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 4.8 tp10 -140.02 105.36 6.75 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 108.142 -1.059 . . . . 51.350000000000001 108.142 -176.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.411 ' HA ' HG12 ' A' ' 77' ' ' ILE . 3.1 Cg_exo -78.43 -32.09 2.42 Favored 'Trans proline' 0 C--N 1.372 1.784 0 C-N-CA 123.139 2.56 . . . . 63.130000000000003 114.283 179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -92.39 16.0 12.72 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.036 0.754 . . . . 65.230000000000004 113.036 -167.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.433 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 1.4 p90 -69.14 120.61 15.25 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-O 121.337 0.589 . . . . 74.299999999999997 110.372 173.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 59.8 mt -82.78 -37.7 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.834 0.854 . . . . 75.209999999999994 110.974 -173.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 10.3 mmpt? -58.58 -32.35 68.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.883 0.873 . . . . 73.109999999999999 112.264 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.433 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -77.73 -37.82 29.21 Favored Glycine 0 C--N 1.342 0.879 0 CA-C-N 115.828 -0.623 . . . . 41.299999999999997 113.525 -177.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 4.9 m-85 -59.93 -42.21 93.48 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.721 0.809 . . . . 75.0 112.888 -175.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 120' ' ' ALA . 10.0 t -66.66 -33.67 76.17 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 122.532 0.333 . . . . 73.450000000000003 111.304 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -80.8 -34.62 33.93 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.616 0.766 . . . . 71.519999999999996 111.129 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -70.03 -43.5 71.19 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.036 0.935 . . . . 74.200000000000003 110.105 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.47 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.8 -36.51 73.04 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.295 -0.866 . . . . 71.140000000000001 111.239 178.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.87 -33.35 75.49 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.061 0.544 . . . . 74.25 111.151 173.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -42.93 74.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 116.093 -0.503 . . . . 63.409999999999997 110.31 174.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 92.8 mt -60.04 -32.77 71.22 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.579 0.751 . . . . 75.430000000000007 111.892 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.481 ' HB2' ' SG ' ' A' ' 127' ' ' CYS . 40.6 tt0 -56.53 -38.83 72.39 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 123.24 0.338 . . . . 72.329999999999998 111.117 170.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.97 -11.44 59.9 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 122.739 0.416 . . . . 53.009999999999998 110.965 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.7 mmt -100.95 1.33 39.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.914 0.885 . . . . 71.319999999999993 111.135 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm 70.61 8.67 6.67 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.205 1.402 . . . . 75.239999999999995 112.402 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -90.48 52.35 2.2 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.97 0.908 . . . . 74.299999999999997 110.259 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -55.92 -36.84 68.16 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.325 1.05 . . . . 63.009999999999998 111.841 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 46.6 p -65.02 -33.04 75.1 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.315 1.046 . . . . 64.400000000000006 111.511 176.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.478 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.3 mmpt? -83.39 -33.0 25.86 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.78 -0.452 . . . . 75.109999999999999 109.78 178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.14 -50.33 70.87 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.022 0.929 . . . . 61.310000000000002 109.776 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.6 ptp -62.73 -27.59 69.38 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 123.939 0.774 . . . . 63.340000000000003 112.02 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -68.19 -36.52 79.71 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.486 0.491 . . . . 75.239999999999995 110.164 174.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 102' ' ' LYS . 63.5 t -78.84 -34.99 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 N-CA-C 109.652 -0.499 . . . . 71.549999999999997 109.652 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.683 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 27.3 m-85 -64.63 -44.05 91.74 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.555 0.742 . . . . 54.329999999999998 110.048 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -51.75 67.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.946 0.898 . . . . 74.340000000000003 109.212 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.51 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.7 mmmt -62.2 -34.97 77.47 Favored 'General case' 0 C--N 1.349 0.585 0 O-C-N 123.911 0.757 . . . . 63.0 111.879 178.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.717 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -64.3 -43.86 93.42 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.752 0.657 . . . . 60.149999999999999 111.355 177.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 76.7 mt -67.74 -31.8 71.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.682 0.793 . . . . 73.439999999999998 110.383 175.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.85 -23.94 61.61 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.429 1.092 . . . . 60.32 110.646 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 86.9 mt -68.37 -54.76 15.09 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 109.096 -0.705 . . . . 73.5 109.096 173.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -166.45 155.29 10.86 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.646 0.378 . . . . 73.209999999999994 111.426 171.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 41.5 m -53.1 -28.93 27.8 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 124.852 1.261 . . . . 64.25 112.112 175.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 68.7 m -51.17 -21.43 2.0 Allowed 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.224 1.01 . . . . 54.130000000000003 112.898 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.717 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 27.9 t -80.35 13.2 2.51 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 113.397 0.888 . . . . 74.120000000000005 113.397 -178.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.406 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.2 mmmt -47.26 -30.4 3.03 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-N 119.27 0.941 . . . . 75.129999999999995 113.379 175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -55.03 -35.92 64.95 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.769 0.828 . . . . 61.329999999999998 111.939 176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.477 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -78.84 -23.52 44.98 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.859 0.864 . . . . 53.240000000000002 111.497 176.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -68.11 -34.73 76.93 Favored 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 109.915 -0.402 . . . . 64.540000000000006 109.915 177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -65.18 -43.35 91.96 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 123.656 0.598 . . . . 65.310000000000002 110.051 173.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.44 ' O ' ' HB2' ' A' ' 126' ' ' ARG . . . -68.11 -22.35 74.24 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-N 115.455 -0.793 . . . . 75.230000000000004 113.314 176.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -60.42 -50.28 74.22 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.934 0.493 . . . . 75.230000000000004 111.113 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -49.89 -38.78 37.22 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 124.06 0.85 . . . . 75.530000000000001 111.657 178.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 123' ' ' GLY . 7.0 mmm180 -55.93 -51.01 69.17 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.282 0.989 . . . . 54.409999999999997 111.867 174.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.683 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 96.3 m -80.26 -42.0 23.96 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 122.904 0.481 . . . . 75.409999999999997 112.087 -169.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.7 ptm -63.15 -45.39 92.13 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 110.615 -0.143 . . . . 72.400000000000006 110.615 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 6.2 ptt? -72.19 -22.54 61.26 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 122.171 0.188 . . . . 74.530000000000001 110.501 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.79 -38.76 92.29 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.678 0.791 . . . . 71.430000000000007 112.219 -176.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -82.35 -22.62 35.45 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.214 0.206 . . . . 74.010000000000005 110.848 173.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.4 m-30 -102.86 37.06 2.03 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.861 0.464 . . . . 72.209999999999994 110.243 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.8 m120 . . . . . 0 N--CA 1.482 1.163 0 N-CA-C 109.079 -0.711 . . . . 71.450000000000003 109.079 176.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 N-CA-C 110.423 -0.214 . . . . 70.329999999999998 110.423 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.97 65.75 3.43 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 120.923 0.18 . . . . 64.230000000000004 113.455 -176.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -85.47 -20.0 30.4 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.899 0.48 . . . . 74.430000000000007 110.82 177.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -74.92 -18.47 60.4 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.679 0.791 . . . . 71.209999999999994 111.966 -174.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -60.15 116.1 3.96 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.748 0.819 . . . . 74.310000000000002 111.03 179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.5 p80 -98.21 110.03 22.68 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.503 0.668 . . . . 74.239999999999995 110.28 179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.7 t60 -76.0 153.67 36.34 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.016 -1.105 . . . . 72.299999999999997 108.016 164.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -46.32 111.38 0.36 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.08 0.952 . . . . 62.219999999999999 112.419 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.3 t -115.12 -178.9 3.48 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 125.005 1.322 . . . . 51.409999999999997 109.4 -178.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -83.63 -169.61 2.65 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.312 0.645 . . . . 73.329999999999998 110.252 171.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 84.3 mtp -54.97 -31.77 61.04 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.781 0.832 . . . . 71.5 112.012 178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -76.43 112.94 24.38 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.004 0.522 . . . . 54.530000000000001 109.627 174.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -70.48 -37.67 7.15 Favored 'Trans proline' 0 C--N 1.378 2.092 0 C-N-CA 122.744 2.296 . . . . 70.420000000000002 112.305 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -158.89 116.22 2.79 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.424 -0.807 . . . . 73.0 109.352 -174.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.494 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -62.9 -28.84 70.33 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.259 0.624 . . . . 72.040000000000006 110.756 -177.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.43 -25.83 67.7 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-N 115.402 -0.817 . . . . 74.099999999999994 112.191 178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -78.16 -20.9 51.1 Favored 'General case' 0 C--N 1.357 0.908 0 N-CA-C 109.535 -0.542 . . . . 74.549999999999997 109.535 177.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.2 mmt -77.85 -39.45 43.41 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-O 121.328 0.585 . . . . 63.439999999999998 110.293 -177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.576 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.2 p -81.1 -27.26 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 CA-C-N 115.065 -0.97 . . . . 64.349999999999994 112.129 -172.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.582 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.4 ptpt -69.47 -28.32 65.98 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.387 -0.196 . . . . 74.530000000000001 110.52 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -63.16 -55.16 27.54 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.982 0.913 . . . . 74.5 110.341 178.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.583 ' HA ' ' HB3' ' A' ' 25' ' ' GLU . 11.0 ptmm? -64.39 -30.31 71.35 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.331 0.653 . . . . 72.340000000000003 111.402 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.81 92.16 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 115.699 -0.682 . . . . 75.450000000000003 112.212 170.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -72.48 -25.41 61.41 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.14 0.576 . . . . 73.430000000000007 110.825 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.583 ' HB3' ' HA ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -61.53 -40.86 96.18 Favored 'General case' 0 C--N 1.357 0.933 0 N-CA-C 109.025 -0.731 . . . . 65.340000000000003 109.025 175.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.512 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 83.9 m -49.91 -50.48 46.02 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 123.769 0.668 . . . . 72.439999999999998 111.984 176.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -57.5 -41.38 80.64 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.099 0.559 . . . . 75.420000000000002 111.305 175.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.7 tp60 -62.32 -26.22 68.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.086 0.954 . . . . 72.219999999999999 110.991 177.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 27.5 mmmt -81.35 -21.24 39.27 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 109.663 -0.495 . . . . 63.329999999999998 109.663 178.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.45 -0.95 46.3 Favored Glycine 0 C--N 1.351 1.375 0 CA-C-N 115.85 -0.614 . . . . 65.200000000000003 112.251 -172.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.4 m-20 -84.92 106.64 16.58 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.038 0.935 . . . . 74.310000000000002 110.887 -178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.476 ' HB3' ' SG ' ' A' ' 59' ' ' CYS . 11.2 m-85 -93.21 -49.72 0.28 Allowed Pre-proline 0 CA--C 1.562 1.431 0 C-N-CA 123.849 0.86 . . . . 71.099999999999994 111.44 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.64 -43.95 9.21 Favored 'Trans proline' 0 C--N 1.397 3.083 0 C-N-CA 121.518 1.478 . . . . 75.25 112.997 178.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.613 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 23.6 mm-40 -59.98 -32.27 70.68 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.826 0.451 . . . . 63.509999999999998 110.893 175.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.55 -33.86 74.56 Favored 'General case' 0 C--N 1.355 0.846 0 O-C-N 123.738 0.649 . . . . 54.409999999999997 111.259 176.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.542 ' SD ' ' HE1' ' A' ' 60' ' ' TYR . 38.5 mtm -66.57 -38.22 86.61 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-O 121.299 0.571 . . . . 74.329999999999998 110.004 -176.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 50.9 mttp -80.8 -32.45 35.31 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 114.61 -1.177 . . . . 70.430000000000007 110.658 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.512 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 6.4 t-80 -78.2 -19.33 54.08 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 114.929 -1.032 . . . . 63.229999999999997 110.601 -179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -85.81 -19.69 30.3 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.432 0.693 . . . . 74.030000000000001 111.891 170.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.427 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 33.8 m -60.71 -38.61 85.61 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 118.552 0.615 . . . . 71.239999999999995 110.396 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -65.84 -31.63 72.69 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.671 0.789 . . . . 73.299999999999997 111.013 174.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.11 -33.53 65.62 Favored 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.407 0.683 . . . . 52.32 110.983 178.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.69 -32.16 56.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.921 0.888 . . . . 74.200000000000003 110.016 175.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -66.73 -29.87 69.95 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.287 0.635 . . . . 61.25 110.983 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.576 ' HG3' HG11 ' A' ' 19' ' ' VAL . 39.3 mmt180 -84.69 -60.3 2.1 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.595 0.758 . . . . 50.219999999999999 110.974 -177.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.3 82.21 18.29 Favored Pre-proline 0 N--CA 1.487 1.396 0 C-N-CA 123.724 0.81 . . . . 74.329999999999998 112.275 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.44 2.06 8.14 Favored 'Trans proline' 0 C--N 1.367 1.543 0 C-N-CA 121.755 1.637 . . . . 52.210000000000001 111.907 166.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.0 mptt -89.68 -21.47 22.72 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.469 0.707 . . . . 72.140000000000001 110.254 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -90.54 116.36 28.38 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 115.588 -0.733 . . . . 60.439999999999998 109.407 -168.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -74.38 -47.28 35.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.575 0.75 . . . . 45.409999999999997 112.619 -170.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.5 ptpp? -66.55 -30.7 71.07 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.85 0.46 . . . . 74.420000000000002 111.241 -175.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.92 -31.47 60.25 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.035 0.934 . . . . 55.140000000000001 112.281 173.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -79.35 -62.27 1.74 Allowed 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.507 -0.923 . . . . 62.32 108.507 172.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.404 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 33.2 t -58.34 -19.88 38.94 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 114.494 1.294 . . . . 74.430000000000007 114.494 -171.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -65.81 -30.1 70.68 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.622 0.769 . . . . 73.319999999999993 110.377 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 73.5 mtm180 -73.62 -27.62 61.37 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 114.986 -1.006 . . . . 71.510000000000005 110.478 176.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -65.41 -36.9 85.32 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.106 0.562 . . . . 63.420000000000002 110.777 173.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.81 -32.01 73.11 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.696 -0.683 . . . . 75.450000000000003 110.714 173.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 32' ' ' TYR . 36.0 t -74.23 -44.69 52.11 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.32 0.648 . . . . 71.510000000000005 110.951 173.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' SD ' ' A' ' 36' ' ' MET . 15.6 m-85 -63.05 -30.09 71.33 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.731 0.812 . . . . 61.25 111.555 -173.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 72.6 p -59.61 -43.04 93.91 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 109.945 -0.391 . . . . 74.409999999999997 109.945 173.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -69.62 -29.86 67.45 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.656 -0.702 . . . . 75.340000000000003 110.823 -177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.6 mt -91.47 2.25 56.56 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.639 -0.71 . . . . 75.209999999999994 110.975 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.415 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.2 mm? 60.96 21.42 11.71 Favored 'General case' 0 C--N 1.375 1.685 0 C-N-CA 123.832 0.853 . . . . 73.420000000000002 111.213 -177.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -89.84 43.86 1.17 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.413 1.485 . . . . 63.310000000000002 110.741 179.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' HE1' HD13 ' A' ' 64' ' ' LEU . 84.8 m-85 -60.31 -25.43 65.76 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.438 0.695 . . . . 73.040000000000006 112.741 -174.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 -58.01 -43.04 86.44 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.737 0.415 . . . . 74.109999999999999 110.06 173.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.4 mt -77.38 -36.84 53.14 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.531 -0.759 . . . . 74.219999999999999 109.393 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -58.69 -43.99 90.14 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.642 0.777 . . . . 41.420000000000002 111.688 -177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 95.3 mt -56.39 -62.66 1.57 Allowed 'General case' 0 N--CA 1.477 0.904 0 O-C-N 123.903 0.752 . . . . 55.100000000000001 110.747 177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -66.09 -29.67 70.03 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 123.912 0.758 . . . . 72.209999999999994 112.311 -173.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -70.69 -43.59 68.74 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.99 0.916 . . . . 63.219999999999999 111.392 -176.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.597 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 26.5 p -81.86 -36.36 28.3 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 119.276 -0.392 . . . . 71.230000000000004 111.966 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.451 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 12.0 pt-20 -77.03 -21.88 53.88 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-N 118.82 0.736 . . . . 72.299999999999997 112.223 -174.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -72.16 -23.58 61.3 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-N 117.83 0.286 . . . . 71.439999999999998 110.37 174.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.678 ' HB3' ' HB1' ' A' ' 50' ' ' ALA . 63.9 m -58.23 -22.88 53.93 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 124.036 0.935 . . . . 65.439999999999998 111.792 178.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -29.85 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 123.982 0.913 . . . . 75.420000000000002 111.199 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.1 -20.87 47.64 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.985 -0.447 . . . . 72.510000000000005 111.883 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 45.1 mt -95.75 -46.5 6.57 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 121.913 0.863 . . . . 73.400000000000006 109.911 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -140.89 98.34 6.95 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 125.58 1.552 . . . . 65.349999999999994 107.168 177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.88 -25.16 75.77 Favored 'Trans proline' 0 C--N 1.379 2.172 0 C-N-CA 123.192 2.595 . . . . 73.239999999999995 112.807 179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 80.7 p -96.69 18.83 13.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.484 1.513 . . . . 74.299999999999997 111.662 -171.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.3 p90 -62.77 106.38 0.79 Allowed 'General case' 0 CA--C 1.557 1.238 0 CA-C-O 121.831 0.824 . . . . 71.239999999999995 111.161 -174.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 89.1 mt -82.32 -44.8 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.76 0.824 . . . . 73.540000000000006 111.003 -171.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -68.61 -31.76 71.16 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 115.789 -0.642 . . . . 74.010000000000005 111.167 -174.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -71.27 -25.67 75.05 Favored Glycine 0 C--N 1.341 0.838 0 CA-C-N 115.105 -0.952 . . . . 52.409999999999997 113.109 178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -65.2 -38.63 91.07 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 122.925 0.49 . . . . 63.32 111.355 177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.8 m -61.27 -39.32 89.94 Favored 'General case' 0 CA--C 1.555 1.137 0 O-C-N 123.766 0.666 . . . . 74.239999999999995 110.624 179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -84.32 -32.6 24.22 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.565 0.746 . . . . 70.340000000000003 112.203 -177.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.597 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 28.7 tptp -66.08 -48.69 70.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.505 0.722 . . . . 70.120000000000005 109.773 178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.593 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -70.89 -33.76 70.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 115.001 -0.999 . . . . 75.099999999999994 111.418 -178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -60.58 -42.36 96.53 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 122.847 0.459 . . . . 55.25 110.604 172.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.86 -45.63 81.43 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 115.543 -0.753 . . . . 53.130000000000003 110.673 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.47 -38.44 74.5 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.814 0.846 . . . . 71.109999999999999 111.403 177.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -58.11 -37.86 75.37 Favored 'General case' 0 CA--C 1.549 0.916 0 O-C-N 123.646 0.591 . . . . 74.340000000000003 110.056 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.53 -14.57 59.63 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.786 0.434 . . . . 74.209999999999994 110.648 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 26.6 mmt -96.56 8.38 44.28 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.707 0.803 . . . . 72.430000000000007 110.596 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt 70.93 8.72 6.62 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 125.113 1.365 . . . . 64.340000000000003 111.88 -178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -90.75 46.07 1.3 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.291 1.037 . . . . 75.519999999999996 111.39 -175.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.478 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 16.8 m-85 -52.34 -37.86 57.14 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.555 1.142 . . . . 75.450000000000003 112.047 179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -62.62 -35.58 80.03 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.971 -1.013 . . . . 63.530000000000001 111.462 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.6 mmtp -79.01 -45.83 19.41 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.363 -0.606 . . . . 75.340000000000003 109.363 179.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.576 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -57.85 -47.87 81.42 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-N 113.997 -1.456 . . . . 71.099999999999994 112.079 -174.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.1 ptp -57.31 -31.79 66.03 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.09 0.869 . . . . 60.119999999999997 112.237 -177.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 60.9 m-20 -67.92 -41.51 82.51 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 123.578 0.549 . . . . 73.25 110.039 175.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.593 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 45.0 t -72.65 -36.99 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 123.517 0.727 . . . . 74.0 109.926 -172.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -61.29 -50.09 74.39 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.856 0.862 . . . . 74.530000000000001 109.945 170.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -57.45 -41.69 81.01 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.432 1.093 . . . . 63.310000000000002 109.866 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.6 mmmt -73.1 -32.97 65.31 Favored 'General case' 0 C--N 1.351 0.67 0 C-N-CA 123.275 0.63 . . . . 71.340000000000003 111.919 -179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.53 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.29 -42.48 99.39 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.04 0.448 . . . . 75.129999999999995 110.096 173.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.9 mt -69.15 -35.01 75.87 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 114.961 -1.018 . . . . 74.540000000000006 110.969 176.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -65.44 -44.79 86.16 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.965 0.906 . . . . 73.319999999999993 110.89 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 38.2 mt -72.92 -33.9 66.26 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 116.214 -0.448 . . . . 70.329999999999998 110.577 179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -154.79 114.44 3.74 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 122.532 0.333 . . . . 73.239999999999995 111.292 -175.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 15.7 t -58.79 -39.44 81.08 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 115.605 -0.725 . . . . 73.439999999999998 110.534 176.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 47.7 t -61.37 -11.3 9.58 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.784 0.834 . . . . 65.010000000000005 111.953 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.53 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 20.9 t -77.19 17.79 0.44 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.352 0.661 . . . . 63.420000000000002 111.731 170.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -38.61 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.58 0 N-CA-C 115.663 1.727 . . . . 62.43 115.663 175.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -55.33 -38.6 68.93 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.178 0.591 . . . . 63.520000000000003 111.347 174.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -68.77 -22.13 64.31 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.567 1.147 . . . . 72.439999999999998 111.882 175.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -71.56 -40.71 69.8 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 109.339 -0.615 . . . . 33.340000000000003 109.339 174.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.34 -40.67 95.1 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.562 -0.745 . . . . 74.030000000000001 109.907 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.69 -34.0 88.73 Favored Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.803 -1.089 . . . . 73.120000000000005 112.884 174.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -63.39 -52.78 60.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.454 0.702 . . . . 64.150000000000006 110.411 176.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -49.08 -53.23 21.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 124.346 1.058 . . . . 75.209999999999994 112.402 -178.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -65.66 -26.7 67.91 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.455 0.702 . . . . 75.519999999999996 111.987 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.576 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 53.2 t -79.71 -52.61 7.73 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.974 0.51 . . . . 63.439999999999998 111.023 -174.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 15.4 ptm -63.37 -43.52 97.39 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 116.018 -0.537 . . . . 73.049999999999997 111.097 179.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 10.8 ptt? -68.23 -23.24 64.78 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.253 0.221 . . . . 54.310000000000002 110.839 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.26 98.92 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 63.329999999999998 111.666 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -82.29 -27.8 32.13 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 116.545 -0.298 . . . . 71.540000000000006 111.108 175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -99.07 36.59 1.68 Allowed 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 109.355 -0.609 . . . . 63.149999999999999 109.355 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 118.337 -0.84 . . . . 70.510000000000005 109.551 -173.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.859 0 N-CA-C 110.128 -0.323 . . . . 62.299999999999997 110.128 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.46 55.44 0.08 OUTLIER Glycine 0 C--N 1.348 1.195 0 CA-C-N 116.444 -0.343 . . . . 65.549999999999997 112.908 179.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -128.15 130.55 48.26 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.399 -0.963 . . . . 72.430000000000007 108.399 170.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.9 t-80 71.51 7.2 5.95 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 125.343 1.457 . . . . 63.409999999999997 111.038 -174.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -71.89 136.85 47.07 Favored 'General case' 0 C--O 1.244 0.767 0 C-N-CA 123.443 0.697 . . . . 74.409999999999997 110.224 -178.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 t60 -157.76 136.97 11.75 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.822 -0.807 . . . . 75.219999999999999 108.822 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -67.19 92.48 0.26 Allowed 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.656 0.741 . . . . 73.109999999999999 110.014 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -91.14 170.96 9.59 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.431 -1.259 . . . . 71.420000000000002 110.896 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 44.5 m -78.34 -175.26 4.13 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.985 0.914 . . . . 33.219999999999999 112.177 -175.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.9 t-80 -54.62 109.68 0.53 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 126.304 1.841 . . . . 62.409999999999997 111.881 -175.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 97.5 mmm -81.42 -71.48 0.47 Allowed 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 110.325 -177.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -62.51 114.22 11.32 Favored Pre-proline 0 C--N 1.354 0.801 0 O-C-N 124.114 0.884 . . . . 74.310000000000002 109.199 -177.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -55.3 -30.97 74.75 Favored 'Trans proline' 0 C--N 1.382 2.307 0 C-N-CA 123.555 2.837 . . . . 75.019999999999996 112.707 -174.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 17' ' ' LEU . 23.4 t70 -159.55 111.4 2.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.654 0.782 . . . . 72.530000000000001 109.072 172.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.42 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.7 mp -61.4 -30.99 70.9 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.301 0.64 . . . . 72.549999999999997 111.5 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -26.85 68.62 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.047 0.539 . . . . 65.439999999999998 111.68 175.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.4 OUTLIER -77.53 -24.83 49.89 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 109.783 -0.451 . . . . 62.32 109.783 177.394 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.3 mmt -81.41 -37.68 27.73 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.008 0.432 . . . . 64.0 110.072 -176.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.09 -29.98 30.28 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-N 115.725 -0.67 . . . . 72.109999999999999 112.006 -176.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.647 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -69.63 -32.14 70.66 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 110.018 -0.364 . . . . 63.439999999999998 110.018 176.619 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -68.99 -42.73 76.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.497 0.719 . . . . 75.209999999999994 111.162 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.48 ' HA ' ' HG2' ' A' ' 25' ' ' GLU . 0.3 OUTLIER -73.67 -33.8 64.61 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.345 0.258 . . . . 71.120000000000005 110.379 179.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.92 -40.5 98.45 Favored Glycine 0 C--N 1.352 1.468 0 N-CA-C 111.838 -0.505 . . . . 63.240000000000002 111.838 170.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.451 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 0.9 OUTLIER -62.48 -51.19 68.45 Favored 'General case' 0 C--O 1.247 0.967 0 C-N-CA 124.204 1.001 . . . . 64.409999999999997 111.111 177.833 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 12.5 pt-20 -66.68 -38.53 86.98 Favored 'General case' 0 C--N 1.35 0.63 0 CA-C-O 118.647 -0.692 . . . . 73.150000000000006 110.053 -174.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 84.5 m -51.91 -54.3 30.95 Favored 'General case' 0 N--CA 1.484 1.231 0 O-C-N 123.968 0.792 . . . . 60.130000000000003 111.741 178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.411 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 70.3 t80 -54.39 -45.38 72.86 Favored 'General case' 0 N--CA 1.477 0.905 0 O-C-N 123.758 0.661 . . . . 73.319999999999993 110.964 176.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -62.44 -28.28 69.7 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 114.576 -1.193 . . . . 75.010000000000005 111.686 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.0 OUTLIER -73.13 -11.23 60.46 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 118.297 0.499 . . . . 65.310000000000002 110.528 -179.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 113.69 13.51 10.31 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.571 0.545 . . . . 74.430000000000007 112.139 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.1 m-20 -93.79 89.83 6.31 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.186 0.594 . . . . 63.32 109.549 -179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -77.33 -53.5 1.62 Allowed Pre-proline 0 CA--C 1.564 1.494 0 CA-C-O 118.862 -0.59 . . . . 75.409999999999997 111.85 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -70.19 -50.44 0.42 Allowed 'Trans proline' 0 C--N 1.395 2.982 0 C-N-CA 121.911 1.741 . . . . 74.340000000000003 112.522 175.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.571 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 32.3 mm-40 -59.04 -23.02 61.64 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.705 0.802 . . . . 64.120000000000005 112.0 -178.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.487 ' HB2' ' O ' ' A' ' 31' ' ' ASP . . . -54.48 -48.76 71.46 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-O 118.399 -0.81 . . . . 40.210000000000001 111.285 173.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.728 ' HG3' ' HE ' ' A' ' 56' ' ' ARG . 3.5 mpp? -57.61 -34.78 69.64 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 123.526 0.516 . . . . 72.239999999999995 110.718 -175.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 51.6 mttm -77.73 -38.34 47.37 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.141 0.976 . . . . 74.150000000000006 110.822 -177.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -69.46 -21.52 63.71 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.355 0.662 . . . . 65.310000000000002 111.044 172.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 54.7 m-85 -88.44 -24.64 22.96 Favored 'General case' 0 C--O 1.217 -0.655 0 CA-C-O 118.672 -0.68 . . . . 72.340000000000003 112.068 169.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.4 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 51.7 m -62.78 -44.89 95.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-N 119.245 0.929 . . . . 74.340000000000003 109.879 -179.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.35 -33.35 73.49 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.17 -0.923 . . . . 73.430000000000007 110.575 174.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.19 -42.11 80.41 Favored 'General case' 0 C--N 1.357 0.898 0 C-N-CA 123.283 0.633 . . . . 65.209999999999994 111.053 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.89 -34.44 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 123.45 0.7 . . . . 74.409999999999997 110.136 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 40' ' ' THR . 72.2 mmtt -64.04 -23.03 67.18 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 122.275 -0.266 . . . . 62.439999999999998 111.492 177.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 mmt180 -94.05 -38.14 11.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.971 0.908 . . . . 73.319999999999993 111.268 176.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -132.95 68.81 78.97 Favored Pre-proline 0 N--CA 1.485 1.312 0 C-N-CA 123.372 0.669 . . . . 75.420000000000002 111.787 -176.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -76.12 -4.42 15.1 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.682 2.255 . . . . 61.420000000000002 113.288 -172.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -97.86 -17.47 19.27 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.657 0.783 . . . . 64.140000000000001 111.083 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HB3' HD23 ' A' ' 52' ' ' LEU . 70.8 m-20 -71.65 94.0 1.3 Allowed 'General case' 0 N--CA 1.474 0.762 0 CA-C-O 121.282 0.563 . . . . 75.310000000000002 111.216 -178.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -60.18 -26.95 66.73 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 125.225 1.41 . . . . 73.430000000000007 112.827 177.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.515 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -72.61 -22.98 60.88 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.015 0.526 . . . . 71.219999999999999 111.683 179.592 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.553 HD23 ' HB3' ' A' ' 49' ' ' ASP . 2.5 mm? -74.35 -36.67 63.63 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.644 0.778 . . . . 64.019999999999996 109.486 173.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -71.4 -41.17 69.93 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.133 -0.94 . . . . 72.239999999999995 111.037 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.2 t -69.66 -29.1 66.48 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.455 1.102 . . . . 72.219999999999999 110.891 -179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -58.69 -45.93 88.4 Favored 'General case' 0 C--O 1.24 0.565 0 O-C-N 124.301 1.0 . . . . 74.540000000000006 109.674 172.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.728 ' HE ' ' HG3' ' A' ' 36' ' ' MET . 16.8 mmm180 -73.58 -38.39 65.16 Favored 'General case' 0 C--N 1.349 0.575 0 CA-C-N 115.247 -0.888 . . . . 73.439999999999998 110.618 -177.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.45 -34.12 73.54 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.056 0.847 . . . . 44.140000000000001 111.097 176.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.26 -41.04 86.23 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.629 -0.714 . . . . 74.540000000000006 110.901 173.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.408 ' SG ' ' NH1' ' A' ' 56' ' ' ARG . 60.9 m -75.46 -30.05 59.83 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.172 0.589 . . . . 72.140000000000001 111.825 -178.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -64.3 -20.06 65.83 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.659 0.784 . . . . 70.510000000000005 112.237 -175.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.4 p -62.32 -46.55 88.21 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 109.635 -0.505 . . . . 71.340000000000003 109.635 171.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -66.73 -33.19 75.09 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 115.369 -0.832 . . . . 65.109999999999999 110.573 -178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 68.2 mt -86.24 -0.89 56.82 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.042 -0.981 . . . . 73.140000000000001 111.45 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 64.8 15.14 9.65 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.771 0.828 . . . . 74.310000000000002 111.597 -177.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -94.09 43.21 1.1 Allowed 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.078 1.351 . . . . 54.119999999999997 110.119 177.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' HD2' ' HA ' ' A' ' 93' ' ' ALA . 91.3 m-85 -56.99 -29.94 63.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.652 0.781 . . . . 54.409999999999997 111.109 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -56.3 -41.07 75.36 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.659 0.784 . . . . 53.539999999999999 110.965 174.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 71' ' ' LYS . 21.6 mt -77.1 -33.66 56.91 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 123.796 0.685 . . . . 75.409999999999997 109.843 178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.71 -27.93 69.6 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.815 0.446 . . . . 70.25 111.55 174.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 81.1 mt -78.37 -62.09 1.8 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.56 0.744 . . . . 65.540000000000006 110.809 173.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' ' HG2' ' A' ' 74' ' ' GLU . 0.5 OUTLIER -70.69 -37.6 73.61 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.4 0.889 . . . . 74.439999999999998 113.4 -168.351 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -64.04 -36.18 83.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 109.86 -0.422 . . . . 74.120000000000005 109.86 175.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.575 ' SG ' ' HE2' ' A' ' 90' ' ' LYS . 54.1 t -74.94 -34.52 62.1 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.774 -0.648 . . . . 64.239999999999995 111.611 178.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.477 ' HG2' ' HA ' ' A' ' 71' ' ' LYS . 8.3 pt-20 -75.15 -26.56 59.22 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.15 0.426 . . . . 70.540000000000006 112.15 -176.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -86.0 -31.17 22.18 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 120.835 0.35 . . . . 70.140000000000001 110.309 176.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.437 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 48.5 t -59.06 -23.59 62.15 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 124.662 1.185 . . . . 71.230000000000004 112.635 -177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.477 HG13 ' HA ' ' A' ' 81' ' ' PRO . 5.9 tt -54.15 -34.88 27.91 Favored 'Isoleucine or valine' 0 C--N 1.359 0.986 0 C-N-CA 124.112 0.965 . . . . 71.140000000000001 111.631 176.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 87.6 mm-40 -65.1 -29.74 70.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.004 0.522 . . . . 74.209999999999994 111.314 -174.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 49.1 mt -85.48 -45.86 11.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 124.102 0.961 . . . . 75.140000000000001 109.349 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.414 ' HB3' ' HB2' ' A' ' 50' ' ' ALA . 10.2 tp10 -148.57 105.15 3.48 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 114.795 -1.093 . . . . 70.430000000000007 109.129 -172.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.477 ' HA ' HG13 ' A' ' 77' ' ' ILE . 61.1 Cg_endo -72.22 -29.52 14.2 Favored 'Trans proline' 0 C--N 1.368 1.585 0 C-N-CA 122.229 1.952 . . . . 53.109999999999999 114.35 177.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 75.6 p -103.86 18.45 21.95 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 113.107 0.78 . . . . 70.140000000000001 113.107 -166.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -70.02 101.73 1.87 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-O 122.372 1.082 . . . . 74.400000000000006 109.015 175.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 85' ' ' LYS . 17.7 mt -75.69 -43.54 40.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.934 -1.03 . . . . 54.149999999999999 111.915 -159.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 0.4 OUTLIER -78.56 -0.56 30.16 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 114.879 -1.055 . . . . 63.539999999999999 110.569 -175.214 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.36 -32.08 26.24 Favored Glycine 0 C--N 1.356 1.646 0 N-CA-C 111.856 -0.498 . . . . 72.430000000000007 111.856 166.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -73.57 -25.8 60.53 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.457 0.703 . . . . 74.420000000000002 111.587 174.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.0 m -63.28 -38.21 90.27 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 122.874 0.47 . . . . 21.5 110.011 172.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 12.3 mmt180 -83.0 -32.34 26.99 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.351 0.66 . . . . 73.120000000000005 110.184 -177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.575 ' HE2' ' SG ' ' A' ' 73' ' ' CYS . 14.2 tppt? -55.68 -52.47 63.76 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 124.171 0.988 . . . . 74.219999999999999 110.052 172.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.543 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.53 -34.86 76.6 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 114.608 -1.178 . . . . 74.200000000000003 111.52 -176.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.79 -41.69 99.38 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.717 0.407 . . . . 53.530000000000001 110.707 173.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.413 ' HA ' ' HD2' ' A' ' 66' ' ' PHE . . . -63.93 -48.13 77.76 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.885 -0.598 . . . . 62.310000000000002 110.754 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.0 mt -56.87 -41.58 78.23 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 124.069 0.948 . . . . 74.030000000000001 111.335 177.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -57.08 -36.63 70.8 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.468 0.707 . . . . 73.209999999999994 111.079 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.6 -15.93 57.97 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 122.97 0.508 . . . . 52.439999999999998 110.335 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.1 mmt -99.43 15.54 26.06 Favored 'General case' 0 C--N 1.357 0.892 0 C-N-CA 123.853 0.861 . . . . 74.219999999999999 109.875 177.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 69.56 6.98 5.99 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 125.271 1.429 . . . . 73.150000000000006 112.627 178.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.533 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 62.3 m-20 -86.73 48.46 1.64 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.733 0.813 . . . . 71.209999999999994 110.392 -176.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -51.35 -39.1 56.36 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.451 0.7 . . . . 63.32 111.496 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.3 p -61.9 -37.8 85.96 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 114.202 -1.363 . . . . 72.129999999999995 111.885 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 6.7 mmpt? -88.25 -28.28 21.21 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.776 0.43 . . . . 74.109999999999999 111.039 -178.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.558 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -70.45 -46.17 64.37 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 123.837 0.855 . . . . 73.340000000000003 110.048 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.481 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 13.9 ptp -57.88 -31.36 66.65 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 124.125 0.891 . . . . 61.229999999999997 111.702 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -64.56 -41.79 96.07 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.126 0.891 . . . . 61.049999999999997 110.513 175.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.543 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 40.4 t -80.12 -29.58 12.58 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 CA-C-N 115.628 -0.715 . . . . 71.329999999999998 109.95 -172.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -66.67 -43.29 84.91 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.199 0.6 . . . . 74.299999999999997 109.977 171.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.9 -49.94 75.44 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.106 0.962 . . . . 73.230000000000004 109.072 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.6 mmmt -68.06 -30.94 70.26 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.852 -0.613 . . . . 74.540000000000006 111.9 -179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.575 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -62.56 -47.45 83.78 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 121.191 0.519 . . . . 54.450000000000003 110.029 173.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 81.3 mt -62.06 -33.99 75.43 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.354 0.661 . . . . 71.140000000000001 111.23 174.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.453 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 28.2 t70 -74.36 -26.87 60.39 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.575 1.15 . . . . 73.0 111.272 -177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 73.7 mt -66.06 -53.19 41.48 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 122.909 0.484 . . . . 73.209999999999994 109.775 175.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -165.5 146.28 7.06 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.465 0.478 . . . . 72.420000000000002 110.635 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.54 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 24.6 t -65.28 -21.48 66.73 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.651 1.18 . . . . 70.030000000000001 112.494 -174.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 32.5 t -63.87 -5.92 5.14 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 118.088 0.404 . . . . 44.020000000000003 111.638 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.575 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 25.8 t -91.07 15.13 12.21 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.125 0.97 . . . . 74.299999999999997 112.697 172.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 115' ' ' SER . 11.8 mmmm -50.82 -22.15 2.02 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 113.519 0.933 . . . . 72.519999999999996 113.519 174.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.51 -32.17 66.75 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.432 0.693 . . . . 53.399999999999999 111.562 172.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -74.67 -19.78 60.14 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.262 1.025 . . . . 72.329999999999998 111.909 176.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.85 -33.33 70.53 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 110.019 -0.363 . . . . 65.140000000000001 110.019 177.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.69 -51.46 69.84 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.472 -0.785 . . . . 71.200000000000003 109.689 173.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -68.02 -28.39 73.41 Favored Glycine 0 C--N 1.345 1.081 0 CA-C-N 115.319 -0.855 . . . . 60.130000000000003 113.694 177.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.481 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 26.2 t80 -61.95 -53.13 59.98 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.157 0.583 . . . . 75.209999999999994 111.186 176.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -55.75 -31.08 62.23 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.702 0.801 . . . . 63.450000000000003 112.091 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.3 ttt85 -74.97 -38.57 61.65 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 122.612 0.365 . . . . 71.109999999999999 110.899 173.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 103' ' ' ALA . 43.2 t -67.34 -49.88 62.25 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.491 0.716 . . . . 64.409999999999997 110.543 -171.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.3 ptm -64.33 -45.1 89.3 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.27 -0.877 . . . . 61.439999999999998 111.466 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 9.5 ptt? -68.95 -24.99 64.33 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 119.461 -0.304 . . . . 75.129999999999995 111.78 -175.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -57.57 -46.54 83.84 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.308 0.575 . . . . 42.25 111.664 -175.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -79.08 -25.86 43.05 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 115.348 -0.842 . . . . 73.420000000000002 111.356 174.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -96.92 34.24 1.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 110.001 -0.37 . . . . 71.120000000000005 110.001 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.552 1.031 0 N-CA-C 108.107 -1.072 . . . . 70.209999999999994 108.107 178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.3 ttp . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 110.742 -0.096 . . . . 72.450000000000003 110.742 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -74.23 78.41 0.96 Allowed Glycine 0 C--N 1.351 1.381 0 C-N-CA 123.072 0.367 . . . . 62.32 113.675 -172.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -98.35 111.74 23.98 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.429 0.692 . . . . 62.119999999999997 110.49 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -85.21 -32.0 22.88 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.76 0.824 . . . . 71.329999999999998 109.668 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 44.2 m80 -78.47 117.54 19.77 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 108.437 -0.949 . . . . 71.230000000000004 108.437 171.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -94.04 157.58 16.03 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.518 0.727 . . . . 70.109999999999999 110.805 -176.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -61.9 137.47 58.25 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.842 0.857 . . . . 64.019999999999996 110.495 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.6 m80 -83.0 68.25 9.42 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.748 0.819 . . . . 74.040000000000006 110.131 -177.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.9 t -111.42 42.32 1.7 Allowed 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.662 0.744 . . . . 42.140000000000001 109.174 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -148.61 133.71 18.25 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 107.994 -1.113 . . . . 74.430000000000007 107.994 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 53.7 mtm -62.5 -31.26 71.98 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.306 0.642 . . . . 71.120000000000005 111.615 -174.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -125.88 91.7 47.73 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.356 1.063 . . . . 63.229999999999997 108.423 169.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.11 -41.76 72.86 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 122.86 2.373 . . . . 75.109999999999999 112.383 -176.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -167.76 112.68 0.68 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.576 -0.898 . . . . 73.409999999999997 108.576 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.2 mp -61.5 -31.29 71.27 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-O 121.425 0.631 . . . . 60.140000000000001 110.386 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 19' ' ' VAL . . . -65.88 -22.16 66.5 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 115.127 -0.942 . . . . 61.409999999999997 112.154 177.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.598 ' HA ' ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -78.76 -23.78 45.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.394 -0.595 . . . . 75.439999999999998 109.394 174.748 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -82.35 -35.47 27.81 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.164 0.586 . . . . 50.210000000000001 110.604 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.612 HG11 ' HG3' ' A' ' 45' ' ' ARG . 7.9 p -78.65 -26.63 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.008 0.523 . . . . 74.329999999999998 111.905 -175.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.598 ' HE2' ' HA ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -73.82 -20.51 60.43 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.406 0.282 . . . . 61.310000000000002 111.026 177.428 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -66.34 -40.85 90.12 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.995 0.918 . . . . 60.530000000000001 111.865 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.493 ' HD2' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -78.01 -20.28 52.81 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 116.773 -0.194 . . . . 61.409999999999997 110.991 176.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.82 -53.86 42.72 Favored Glycine 0 C--N 1.346 1.095 0 N-CA-C 111.802 -0.519 . . . . 60.310000000000002 111.802 169.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -75.51 -29.64 59.56 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 119.569 -0.253 . . . . 73.209999999999994 111.42 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 1.5 pt-20 -68.72 -41.83 78.52 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 110.006 -0.368 . . . . 72.340000000000003 110.006 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 29' ' ' LYS . 84.6 m -62.69 -39.11 92.97 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 111.655 0.243 . . . . 53.25 111.655 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -55.94 -46.59 78.47 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 115.392 -0.822 . . . . 72.439999999999998 109.683 173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -66.73 -21.01 66.08 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 113.91 -1.495 . . . . 74.040000000000006 111.874 178.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.2 OUTLIER -82.97 -8.99 59.51 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.625 -0.509 . . . . 74.010000000000005 109.625 177.408 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.41 -21.41 37.24 Favored Glycine 0 C--N 1.351 1.39 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 112.292 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -85.24 85.05 7.49 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.318 0.647 . . . . 71.310000000000002 109.281 -176.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.416 ' N ' ' HD2' ' A' ' 33' ' ' PRO . 15.4 m-85 -68.14 -38.16 12.97 Favored Pre-proline 0 CA--C 1.558 1.265 0 CA-C-N 114.971 -1.013 . . . . 72.239999999999995 113.008 -176.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.416 ' HD2' ' N ' ' A' ' 32' ' ' TYR . 9.8 Cg_endo -53.62 -54.53 4.72 Favored 'Trans proline' 0 C--N 1.394 2.949 0 C-N-CA 121.687 1.591 . . . . 63.140000000000001 112.176 168.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 9.7 tp-100 -60.96 -32.67 72.2 Favored 'General case' 0 N--CA 1.495 1.796 0 CA-C-N 118.174 0.443 . . . . 64.5 111.787 -176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.78 -49.25 73.69 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.358 -0.837 . . . . 73.049999999999997 110.558 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.0 tmm? -73.75 -26.23 60.56 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.733 -1.121 . . . . 64.439999999999998 110.225 -174.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -71.59 -47.71 52.95 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.395 0.678 . . . . 72.219999999999999 110.53 176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -66.51 -29.58 69.72 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.758 -0.655 . . . . 74.430000000000007 111.038 176.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -69.75 -46.73 65.21 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.573 173.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.4 m -62.35 -34.57 76.93 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 122.93 0.492 . . . . 62.030000000000001 110.604 -179.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -63.97 -44.35 93.02 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.671 1.188 . . . . 72.409999999999997 110.291 171.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.05 -31.42 72.63 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.78 -0.645 . . . . 53.130000000000003 111.3 177.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.5 mp -63.91 -32.24 56.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 C-N-CA 124.125 0.97 . . . . 72.040000000000006 110.294 176.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -73.34 -24.43 60.36 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 122.709 0.404 . . . . 74.209999999999994 110.432 177.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.612 ' HG3' HG11 ' A' ' 19' ' ' VAL . 15.7 mmp_? -84.35 -36.54 22.44 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.042 0.937 . . . . 74.120000000000005 110.89 177.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.565 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.4 OUTLIER -141.61 72.93 24.75 Favored Pre-proline 0 N--CA 1.482 1.13 0 C-N-CA 123.851 0.86 . . . . 53.219999999999999 111.305 -177.309 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.48 -9.1 24.59 Favored 'Trans proline' 0 C--N 1.371 1.73 0 C-N-CA 122.515 2.143 . . . . 72.209999999999994 112.571 -178.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.427 ' HA ' HD22 ' A' ' 79' ' ' LEU . 13.7 mmmm -90.81 -7.08 53.34 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.171 0.988 . . . . 71.129999999999995 111.422 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -88.94 118.35 28.6 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.369 -0.604 . . . . 75.420000000000002 109.369 -176.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 76' ' ' CYS . . . -76.34 -39.15 54.73 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.538 0.735 . . . . 63.509999999999998 112.53 -174.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -23.65 57.29 Favored 'General case' 0 N--CA 1.48 1.064 0 O-C-N 122.4 -0.187 . . . . 61.049999999999997 110.699 -173.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.565 ' HG ' HD21 ' A' ' 46' ' ' ASN . 0.7 OUTLIER -61.59 -34.1 75.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.423 0.689 . . . . 74.150000000000006 110.977 176.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.658 ' HB2' ' SG ' ' A' ' 76' ' ' CYS . 97.1 m-85 -74.66 -44.83 48.36 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 116.068 -0.514 . . . . 71.209999999999994 110.681 172.391 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 94.1 p -63.93 -22.49 66.95 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 112.047 0.388 . . . . 75.299999999999997 112.047 -176.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -71.22 -41.9 69.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.761 0.824 . . . . 71.450000000000003 110.554 172.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.0 mtp-105 -66.03 -37.74 86.62 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.047 0.539 . . . . 73.340000000000003 110.908 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.55 -36.73 85.17 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.706 0.802 . . . . 71.140000000000001 110.709 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.51 -27.61 65.34 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.723 0.809 . . . . 54.409999999999997 111.399 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 69.4 m -73.13 -45.79 54.83 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 109.562 -0.532 . . . . 75.239999999999995 109.562 170.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -61.77 -31.97 72.21 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.823 0.849 . . . . 75.239999999999995 111.889 -174.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 62.2 p -60.81 -44.82 96.36 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-O 120.659 0.266 . . . . 71.420000000000002 110.348 172.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -66.99 -32.18 73.25 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 123.918 0.887 . . . . 73.25 110.586 -177.638 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.1 mt -87.29 3.3 47.27 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 114.751 -1.113 . . . . 72.129999999999995 111.075 -178.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 69.22 5.64 5.22 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.285 1.034 . . . . 73.230000000000004 112.101 -177.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -85.26 47.04 1.35 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.196 1.398 . . . . 74.409999999999997 110.639 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 86.1 m-85 -56.86 -31.02 64.37 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.853 0.861 . . . . 73.319999999999993 111.672 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -52.92 -40.83 63.89 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.53 0.732 . . . . 74.530000000000001 110.444 174.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.5 mt -78.84 -43.96 24.04 Favored 'General case' 0 C--O 1.216 -0.658 0 CA-C-N 115.248 -0.887 . . . . 71.040000000000006 109.531 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -56.8 -31.07 64.32 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.862 0.865 . . . . 55.340000000000003 112.555 -178.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 38.4 mt -64.93 -66.62 0.52 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.14 0.576 . . . . 72.040000000000006 109.684 173.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -66.02 -23.96 66.66 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.538 0.735 . . . . 74.120000000000005 112.526 -171.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -76.87 -34.46 57.8 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 124.05 0.94 . . . . 74.25 110.355 -175.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.442 ' SG ' ' HD3' ' A' ' 90' ' ' LYS . 21.1 p -82.07 -35.36 28.75 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 116.044 -0.525 . . . . 73.019999999999996 109.91 173.12 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -60.48 -30.36 69.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.265 0.626 . . . . 73.209999999999994 112.581 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -79.89 -26.51 40.23 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 122.365 -0.21 . . . . 74.209999999999994 111.479 178.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 53' ' ' TYR . 36.6 m -61.05 -24.98 66.6 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.494 0.718 . . . . 52.130000000000003 111.961 179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.409 HG23 HE21 ' A' ' 78' ' ' GLN . 0.3 OUTLIER -62.9 -28.52 45.18 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 C-N-CA 123.753 0.821 . . . . 72.040000000000006 110.392 178.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.409 HE21 HG23 ' A' ' 77' ' ' ILE . 27.4 mm-40 -73.12 -26.75 61.35 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.494 0.718 . . . . 73.439999999999998 111.156 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 48' ' ' LYS . 63.6 mt -91.72 -51.77 5.07 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 110.588 -177.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -149.89 105.98 3.22 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 124.378 1.071 . . . . 65.120000000000005 108.745 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -63.04 -19.87 70.06 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 123.25 2.634 . . . . 75.120000000000005 114.397 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.7 p -89.74 15.8 9.07 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 112.837 0.68 . . . . 65.230000000000004 112.837 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.479 ' CE2' ' HA3' ' A' ' 86' ' ' GLY . 10.7 p90 -64.0 109.16 1.7 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 109.33 -0.618 . . . . 72.230000000000004 109.33 174.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 39.2 mt -80.9 -43.95 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 O-C-N 121.763 -0.586 . . . . 52.219999999999999 111.407 -169.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.0 mmpt? -62.24 -30.9 71.43 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.059 0.544 . . . . 75.439999999999998 111.825 -176.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.479 ' HA3' ' CE2' ' A' ' 83' ' ' PHE . . . -67.2 -43.69 88.71 Favored Glycine 0 C--O 1.215 -1.077 0 CA-C-O 119.16 -0.8 . . . . 63.539999999999999 112.348 174.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.424 ' HB3' ' HB2' ' A' ' 110' ' ' ALA . 7.6 m-85 -61.25 -42.21 98.22 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 117.325 0.562 . . . . 65.120000000000005 111.304 173.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.617 HG23 ' HB2' ' A' ' 120' ' ' ALA . 8.2 m -62.71 -45.2 93.86 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.71 0.804 . . . . 71.099999999999994 110.526 -176.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.432 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 4.9 mpt_? -82.58 -24.16 34.07 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-N 115.196 -0.911 . . . . 74.510000000000005 111.507 -178.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.442 ' HD3' ' SG ' ' A' ' 73' ' ' CYS . 23.5 tptm -71.09 -43.71 67.17 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.38 0.672 . . . . 75.099999999999994 109.293 176.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -64.55 -40.18 95.11 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.257 -0.883 . . . . 52.32 110.545 177.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.43 -32.72 72.96 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.618 0.767 . . . . 75.319999999999993 111.645 176.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 97' ' ' MET . . . -72.33 -49.48 34.06 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.021 0.528 . . . . 60.439999999999998 110.448 178.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 81.4 mt -59.04 -39.72 82.88 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.635 0.774 . . . . 72.319999999999993 110.911 176.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -54.64 -40.32 68.86 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.795 0.838 . . . . 73.019999999999996 109.59 171.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -76.42 -13.85 60.09 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.94 0.496 . . . . 73.430000000000007 111.396 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 93' ' ' ALA . 23.7 mmt -98.62 9.92 42.19 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.602 0.761 . . . . 72.200000000000003 109.932 177.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm 69.87 8.13 6.56 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 125.441 1.496 . . . . 64.420000000000002 112.322 -178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -88.62 48.98 1.71 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.282 1.033 . . . . 75.030000000000001 111.016 -176.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 20.1 m-85 -52.54 -37.46 57.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.161 0.985 . . . . 72.099999999999994 112.317 178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.7 p -60.61 -37.28 80.89 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 124.183 0.927 . . . . 43.149999999999999 111.619 176.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 60.7 mmtt -84.0 -37.17 22.54 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.346 0.593 . . . . 73.209999999999994 109.562 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.06 -42.2 97.1 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 114.675 -1.148 . . . . 43.420000000000002 111.363 -175.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 124' ' ' TYR . 16.6 ptp -60.61 -30.37 69.79 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.581 0.752 . . . . 74.040000000000006 112.591 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -64.41 -40.44 95.79 Favored 'General case' 0 C--N 1.352 0.681 0 O-C-N 123.626 0.578 . . . . 63.420000000000002 110.098 171.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.2 t -79.15 -28.27 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.019 0 C-N-CA 122.89 0.476 . . . . 72.420000000000002 110.289 -175.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.457 ' HD1' ' HB1' ' A' ' 120' ' ' ALA . 49.2 m-85 -65.83 -48.46 71.58 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 74.230000000000004 109.544 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.31 -49.72 75.88 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 124.134 0.896 . . . . 71.420000000000002 109.395 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.502 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 31.3 mmmt -64.94 -29.92 70.88 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.37 0.668 . . . . 72.450000000000003 112.478 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.706 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -67.55 -45.47 75.55 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 122.789 0.436 . . . . 73.409999999999997 110.164 174.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 85.9 mt -65.47 -30.69 71.49 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-N 115.481 -0.781 . . . . 61.340000000000003 111.134 174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 17.1 t70 -69.32 -38.74 78.38 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.992 1.317 . . . . 72.519999999999996 110.503 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 82.1 mt -58.43 -58.58 7.89 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 123.798 0.686 . . . . 74.430000000000007 110.189 176.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -165.38 149.3 8.41 Favored 'General case' 0 C--O 1.251 1.15 0 CA-C-N 115.918 -0.583 . . . . 74.019999999999996 109.945 175.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 52.5 p -64.01 -9.42 15.85 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 114.912 -1.04 . . . . 75.140000000000001 112.182 -178.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 54.3 p -59.14 -14.17 9.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.889 0.476 . . . . 70.329999999999998 111.97 171.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.706 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 11.9 t -93.5 13.85 20.51 Favored 'General case' 0 CA--C 1.553 1.061 0 N-CA-C 113.286 0.847 . . . . 60.210000000000001 113.286 176.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 115' ' ' SER . 4.3 mmmp? -49.24 -24.26 1.7 Allowed 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 113.785 1.032 . . . . 73.349999999999994 113.785 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -57.4 -37.6 72.96 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.19 0.596 . . . . 74.120000000000005 111.599 173.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.617 ' HB2' HG23 ' A' ' 88' ' ' THR . . . -75.18 -16.88 60.47 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.768 0.827 . . . . 74.219999999999999 111.769 177.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.76 -40.7 72.52 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 109.126 -0.694 . . . . 73.510000000000005 109.126 175.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.019 -0.991 . . . . 74.129999999999995 110.474 173.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.15 -21.55 79.68 Favored Glycine 0 C--N 1.352 1.421 0 CA-C-N 115.556 -0.747 . . . . 74.420000000000002 113.682 176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.43 ' HE1' ' HB2' ' A' ' 104' ' ' MET . 22.0 t80 -65.11 -46.22 81.92 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.496 0.718 . . . . 73.200000000000003 110.754 174.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.51 -40.55 65.5 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.16 0.584 . . . . 65.319999999999993 111.214 174.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -62.57 -42.05 99.31 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 123.753 0.658 . . . . 72.200000000000003 111.074 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 53.5 t -65.5 -52.41 52.91 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.178 0.591 . . . . 73.230000000000004 110.757 -170.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.5 ptm -63.41 -48.12 79.13 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.568 -0.742 . . . . 53.240000000000002 111.331 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.9 ptm -66.72 -28.77 68.69 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 118.093 0.406 . . . . 74.439999999999998 111.52 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.67 -34.53 74.46 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.68 0.792 . . . . 72.349999999999994 112.551 -173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.437 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 17.3 pt20 -89.68 -22.38 22.28 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.21 0.604 . . . . 72.519999999999996 111.263 173.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -97.32 38.34 1.27 Allowed 'General case' 0 N--CA 1.482 1.137 0 CA-C-O 121.194 0.521 . . . . 74.209999999999994 110.087 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 12.6 m120 . . . . . 0 C--O 1.251 1.145 0 N-CA-C 108.009 -1.108 . . . . 73.439999999999998 108.009 172.765 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 110.463 -0.199 . . . . 60.299999999999997 110.463 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.77 108.8 0.39 Allowed Glycine 0 C--N 1.343 0.946 0 N-CA-C 110.944 -0.862 . . . . 73.209999999999994 110.944 176.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -65.29 119.98 11.92 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.286 0.634 . . . . 72.439999999999998 109.562 175.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -75.25 100.34 4.31 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.222 0.534 . . . . 71.439999999999998 109.689 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -128.53 162.73 26.55 Favored 'General case' 0 C--O 1.246 0.881 0 C-N-CA 125.007 1.323 . . . . 73.340000000000003 108.791 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -58.13 127.85 34.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.593 0.757 . . . . 71.040000000000006 110.524 176.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -67.99 156.46 37.26 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.187 0.595 . . . . 74.099999999999994 111.539 -170.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -81.86 162.69 22.71 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.185 0.994 . . . . 74.010000000000005 109.99 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 t -70.04 165.32 22.12 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.047 0.539 . . . . 70.140000000000001 110.498 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 p-80 -73.78 78.08 1.58 Allowed 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 123.678 0.791 . . . . 75.040000000000006 111.803 -172.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.1 mmm -71.87 -48.78 43.48 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.328 -0.99 . . . . 74.340000000000003 108.328 175.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -69.59 131.78 89.62 Favored Pre-proline 0 CA--C 1.551 0.989 0 CA-C-N 114.494 -1.23 . . . . 73.150000000000006 108.634 163.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -53.0 -46.62 32.62 Favored 'Trans proline' 0 C--N 1.376 1.985 0 C-N-CA 123.117 2.545 . . . . 74.209999999999994 113.022 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.521 ' HB3' HD23 ' A' ' 17' ' ' LEU . 33.6 t70 -163.46 114.55 1.4 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.543 0.337 . . . . 52.32 110.507 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.544 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.0 mp -61.69 -36.14 80.04 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.716 0.807 . . . . 74.109999999999999 109.92 -176.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.82 -27.13 68.55 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.117 -0.947 . . . . 71.420000000000002 111.857 179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -79.76 -26.17 40.77 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.458 -0.571 . . . . 55.340000000000003 109.458 178.531 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 19.3 mmt -76.95 -43.69 34.26 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.363 0.665 . . . . 75.530000000000001 110.103 -174.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.548 HG11 ' HG3' ' A' ' 45' ' ' ARG . 10.3 p -68.74 -35.31 69.2 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 CA-C-N 114.736 -1.12 . . . . 62.240000000000002 111.795 -174.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.5 ptpt -71.19 -30.47 66.44 Favored 'General case' 0 C--N 1.352 0.704 0 CA-C-N 116.606 -0.27 . . . . 72.530000000000001 110.556 -177.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -66.49 -54.18 26.83 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 123.929 0.892 . . . . 63.450000000000003 110.361 176.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -24.5 63.8 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 116.026 -0.533 . . . . 63.210000000000001 111.078 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.56 -51.42 59.15 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.586 -0.734 . . . . 73.219999999999999 112.834 172.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -77.87 -21.99 50.48 Favored 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 112.255 0.465 . . . . 74.25 112.255 178.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 2.1 pt-20 -72.32 -31.9 66.08 Favored 'General case' 0 C--N 1.356 0.86 0 N-CA-C 109.006 -0.739 . . . . 55.439999999999998 109.006 176.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.521 ' SG ' ' HD2' ' A' ' 38' ' ' HIS . 41.6 t -57.09 -41.89 79.69 Favored 'General case' 0 C--N 1.363 1.171 0 O-C-N 123.397 0.436 . . . . 63.130000000000003 111.487 174.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -60.25 -43.9 95.72 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.428 0.691 . . . . 74.299999999999997 109.775 177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -61.68 -26.46 68.04 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 114.669 -1.15 . . . . 72.230000000000004 111.458 175.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 0.6 OUTLIER -71.46 -14.18 62.06 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 117.999 0.363 . . . . 55.219999999999999 110.504 -179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.45 6.9 54.8 Favored Glycine 0 C--N 1.35 1.306 0 N-CA-C 112.149 -0.381 . . . . 61.240000000000002 112.149 -178.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.544 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 20.8 m-20 -100.7 98.66 9.18 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 108.964 -0.754 . . . . 71.340000000000003 108.964 178.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.85 -54.8 2.63 Favored Pre-proline 0 CA--C 1.565 1.552 0 CA-C-O 118.361 -0.828 . . . . 72.25 111.257 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -65.34 -44.46 8.98 Favored 'Trans proline' 0 C--N 1.396 3.07 0 CA-C-N 121.027 1.403 . . . . 74.129999999999995 111.801 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.544 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -61.15 -31.48 71.2 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.911 0.484 . . . . 75.200000000000003 111.36 179.16 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.53 -40.03 93.17 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.003 0.521 . . . . 63.310000000000002 110.723 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.408 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 42.7 ttp -67.8 -34.45 76.78 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 124.142 0.901 . . . . 75.420000000000002 109.517 -177.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -73.09 -38.85 66.24 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.841 0.856 . . . . 72.150000000000006 110.553 178.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.521 ' HD2' ' SG ' ' A' ' 26' ' ' CYS . 23.1 m-70 -74.26 -18.69 60.7 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 115.477 -0.783 . . . . 75.340000000000003 111.291 175.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -76.74 -40.46 48.4 Favored 'General case' 0 C--O 1.216 -0.708 0 C-N-CA 122.872 0.469 . . . . 73.340000000000003 110.414 167.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 40.4 m -65.64 -39.89 91.93 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.572 0.349 . . . . 64.099999999999994 111.143 -173.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -64.37 -30.56 71.6 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.217 0.323 . . . . 72.049999999999997 110.259 173.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.0 -35.11 69.35 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 123.347 0.659 . . . . 73.209999999999994 111.051 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.76 -36.53 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.345 -0.613 . . . . 73.329999999999998 109.345 172.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' THR . 74.3 mmtt -68.38 -26.73 65.72 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.092 0.557 . . . . 51.219999999999999 111.532 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.3 mmt180 -90.84 -34.67 15.18 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.457 0.703 . . . . 73.329999999999998 110.787 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -148.85 80.29 8.17 Favored Pre-proline 0 CA--C 1.56 1.341 0 C-N-CA 123.75 0.82 . . . . 73.209999999999994 110.756 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -78.25 -15.6 14.25 Favored 'Trans proline' 0 C--N 1.375 1.938 0 C-N-CA 123.26 2.64 . . . . 35.240000000000002 113.73 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -71.85 -36.02 70.02 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.075 -0.713 . . . . 71.25 109.075 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -63.23 97.27 0.12 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.022 -0.99 . . . . 52.509999999999998 111.216 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.711 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -72.19 -18.49 61.85 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.984 -0.553 . . . . 62.420000000000002 110.859 171.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.547 ' HD3' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -64.3 -19.18 65.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.378 0.671 . . . . 74.319999999999993 112.145 174.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.547 HD22 ' HD3' ' A' ' 51' ' ' LYS . 4.2 mm? -76.06 -41.78 49.57 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 122.738 0.415 . . . . 71.329999999999998 110.788 169.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.408 ' HA ' ' HG2' ' A' ' 56' ' ' ARG . 90.3 m-85 -68.29 -39.76 81.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.931 0.892 . . . . 75.25 111.618 -176.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.6 p -73.51 -27.14 61.2 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.987 0.515 . . . . 63.350000000000001 111.329 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -70.74 -42.34 70.63 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.603 0.761 . . . . 62.119999999999997 110.85 172.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HG2' ' HA ' ' A' ' 53' ' ' TYR . 17.8 ptt180 -76.23 -21.43 56.39 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 110.139 -0.319 . . . . 65.019999999999996 110.139 178.024 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.17 -35.37 66.42 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.297 0.639 . . . . 51.140000000000001 110.097 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.13 -18.97 64.02 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.468 0.707 . . . . 64.310000000000002 111.019 172.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.31 -44.36 17.77 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.358 0.663 . . . . 73.140000000000001 109.967 169.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.408 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 16.0 m-85 -58.55 -34.48 71.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.648 0.779 . . . . 72.219999999999999 111.905 -178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 47.7 p -60.37 -39.69 88.13 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 122.502 0.321 . . . . 73.340000000000003 110.594 174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -68.42 -34.53 76.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.636 0.775 . . . . 53.420000000000002 110.27 -177.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 64.3 mt -81.95 1.19 36.54 Favored 'General case' 0 CA--C 1.554 1.124 0 CA-C-N 114.75 -1.114 . . . . 75.530000000000001 111.174 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 66.03 15.51 10.1 Favored 'General case' 0 C--N 1.373 1.593 0 C-N-CA 124.595 1.158 . . . . 75.239999999999995 111.36 -176.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -90.68 44.6 1.21 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.7 1.6 . . . . 73.519999999999996 110.668 177.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -57.37 -27.78 62.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.971 0.908 . . . . 63.32 111.563 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -57.49 -39.51 76.61 Favored 'General case' 0 N--CA 1.479 0.989 0 O-C-N 123.549 0.53 . . . . 73.319999999999993 110.585 175.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 27.6 mt -76.61 -40.54 49.08 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-N 115.703 -0.68 . . . . 73.340000000000003 109.226 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.48 81.77 Favored 'General case' 0 C--N 1.354 0.766 0 C-N-CA 123.838 0.855 . . . . 74.400000000000006 111.523 -177.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.61 HD11 ' HG3' ' A' ' 97' ' ' MET . 85.0 mt -65.82 -64.06 0.95 Allowed 'General case' 0 C--N 1.356 0.87 0 C-N-CA 124.134 0.974 . . . . 72.200000000000003 110.113 178.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -61.27 -33.11 73.01 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 124.271 0.982 . . . . 74.510000000000005 112.098 -173.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -73.05 -41.79 63.79 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.151 0.58 . . . . 71.299999999999997 110.676 -177.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 29.6 p -76.67 -22.66 53.72 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 122.494 0.317 . . . . 74.510000000000005 111.363 176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.41 -59.62 4.44 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.089 0.555 . . . . 63.399999999999999 109.865 170.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -69.37 -18.34 63.78 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.807 0.843 . . . . 73.540000000000006 112.008 -177.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.655 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 16.6 t -50.72 -25.78 4.75 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.711 1.204 . . . . 72.319999999999993 112.554 171.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.479 HG12 ' HB3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -59.98 -36.94 70.23 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 123.585 0.754 . . . . 75.150000000000006 110.737 176.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -72.76 -30.54 64.21 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 122.973 0.509 . . . . 75.409999999999997 111.0 -174.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.578 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 84.1 mt -85.57 -60.02 2.15 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.291 0.637 . . . . 62.350000000000001 110.025 178.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.711 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 55.8 tt0 -149.49 97.93 3.49 Favored Pre-proline 0 CA--C 1.561 1.39 0 C-N-CA 124.007 0.923 . . . . 70.25 110.022 -176.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.479 ' HB3' HG12 ' A' ' 77' ' ' ILE . 34.3 Cg_endo -88.43 -2.62 6.78 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 123.713 2.942 . . . . 63.409999999999997 113.198 177.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 39.8 p -83.23 -9.82 58.92 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.047 0.539 . . . . 64.200000000000003 111.482 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -75.17 101.63 4.67 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.231 0.612 . . . . 75.340000000000003 109.948 -179.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.7 HG23 ' SG ' ' A' ' 117' ' ' CYS . 11.4 mt -58.03 -41.53 80.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 125.526 1.53 . . . . 64.299999999999997 112.435 -177.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt -67.76 -22.58 65.2 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 122.755 0.422 . . . . 64.209999999999994 111.131 -176.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.28 -34.22 87.39 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.531 0.52 . . . . 75.430000000000007 112.239 175.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -76.97 -32.04 56.97 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.196 0.999 . . . . 74.409999999999997 110.871 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 13.6 m -69.32 -42.52 75.28 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 122.842 0.457 . . . . 73.519999999999996 110.516 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -39.99 95.74 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.919 0.888 . . . . 75.049999999999997 110.171 173.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -59.74 -54.6 44.43 Favored 'General case' 0 C--N 1.354 0.763 0 C-N-CA 123.774 0.83 . . . . 50.200000000000003 111.285 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.49 85.31 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.486 0.714 . . . . 73.310000000000002 111.689 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.29 68.42 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.42 0.688 . . . . 73.049999999999997 112.176 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.85 -48.7 57.87 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 109.904 -0.406 . . . . 64.140000000000001 109.904 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.539 HD13 ' HB2' ' A' ' 102' ' ' LYS . 92.5 mt -55.33 -42.37 73.7 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.035 0.934 . . . . 63.039999999999999 110.649 173.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -54.06 -38.36 65.17 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.447 0.699 . . . . 75.400000000000006 111.019 174.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.31 -20.71 60.74 Favored 'General case' 0 C--N 1.358 0.955 0 C-N-CA 122.708 0.403 . . . . 55.310000000000002 110.3 -178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG3' HD11 ' A' ' 70' ' ' LEU . 23.6 mmt -100.61 8.84 43.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.114 0.966 . . . . 60.210000000000001 111.604 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm 73.53 8.8 5.06 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.361 1.465 . . . . 73.329999999999998 112.319 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -83.92 45.52 1.09 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.655 1.182 . . . . 74.349999999999994 112.031 -177.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.449 ' HA ' ' SG ' ' A' ' 127' ' ' CYS . 14.4 m-85 -54.63 -37.9 66.2 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.436 1.094 . . . . 75.040000000000006 111.971 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.518 ' HA ' ' SD ' ' A' ' 104' ' ' MET . 45.0 p -62.36 -34.43 76.66 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 114.945 -1.025 . . . . 73.400000000000006 111.952 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.539 ' HB2' HD13 ' A' ' 94' ' ' LEU . 22.6 mmtp -79.75 -43.52 22.42 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 108.937 -0.764 . . . . 63.100000000000001 108.937 -179.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.447 ' HB3' ' SG ' ' A' ' 127' ' ' CYS . . . -58.89 -37.82 77.44 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.901 -1.045 . . . . 44.140000000000001 111.499 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.518 ' SD ' ' HA ' ' A' ' 101' ' ' THR . 0.5 OUTLIER -69.0 -18.69 64.09 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.016 0.927 . . . . 61.229999999999997 111.875 179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -83.06 -33.33 26.46 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.954 -0.466 . . . . 73.099999999999994 110.545 166.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 102' ' ' LYS . 71.6 t -71.63 -37.81 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 123.512 0.725 . . . . 73.439999999999998 110.807 -171.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -63.05 -37.25 86.43 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 123.564 0.54 . . . . 74.019999999999996 109.734 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.02 -44.38 84.87 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 124.409 1.084 . . . . 75.340000000000003 108.221 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -66.97 -30.54 70.69 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.236 -0.893 . . . . 71.040000000000006 111.808 178.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.773 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -69.74 -44.06 71.02 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.127 0.571 . . . . 44.539999999999999 110.639 175.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -66.22 -30.8 71.33 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.506 0.723 . . . . 73.140000000000001 110.562 174.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -64.89 -33.84 76.98 Favored 'General case' 0 C--N 1.355 0.813 0 C-N-CA 124.208 1.003 . . . . 75.140000000000001 110.39 179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.8 mt -65.03 -53.21 49.59 Favored 'General case' 0 C--N 1.353 0.74 0 N-CA-C 109.407 -0.59 . . . . 75.120000000000005 109.407 173.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -165.16 143.64 6.37 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 115.953 -0.567 . . . . 72.150000000000006 110.556 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 14.4 m -62.36 -29.98 70.85 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.807 0.843 . . . . 64.430000000000007 111.452 -179.242 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.3 t -64.92 -2.37 2.59 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.782 0.833 . . . . 72.510000000000005 111.855 178.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.773 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 33.6 t -84.62 17.14 2.83 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.258 1.023 . . . . 64.319999999999993 111.947 168.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 115' ' ' SER . 29.9 mmmt -38.76 -29.45 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.585 0 N-CA-C 115.221 1.563 . . . . 75.549999999999997 115.221 175.323 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -53.12 -37.15 61.53 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.807 0.843 . . . . 65.439999999999998 112.368 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.82 79.35 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.539 0.736 . . . . 72.409999999999997 110.804 174.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.83 -42.49 70.14 Favored 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.443 -0.577 . . . . 44.210000000000001 109.443 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -56.49 -44.57 80.79 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.274 1.03 . . . . 75.230000000000004 110.369 172.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -66.75 -28.59 73.84 Favored Glycine 0 C--N 1.347 1.157 0 CA-C-N 115.08 -0.964 . . . . 73.530000000000001 112.449 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.421 ' HE1' ' HE2' ' A' ' 104' ' ' MET . 29.7 t80 -63.06 -49.18 75.54 Favored 'General case' 0 C--N 1.361 1.104 0 C-N-CA 123.234 0.614 . . . . 74.430000000000007 110.737 173.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -51.08 -36.7 41.53 Favored 'General case' 0 N--CA 1.486 1.325 0 O-C-N 123.483 0.49 . . . . 71.439999999999998 111.702 177.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 28.7 ttt85 -74.55 -35.56 63.09 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.905 0.882 . . . . 75.099999999999994 111.226 175.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.449 ' SG ' ' HA ' ' A' ' 100' ' ' TYR . 41.9 t -76.16 -37.88 57.36 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.852 0.861 . . . . 74.340000000000003 111.337 -172.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 20.4 ptm -75.63 -41.16 54.95 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.183 0.593 . . . . 72.400000000000006 110.863 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.8 ptm -69.01 -26.16 64.86 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 117.965 0.348 . . . . 70.230000000000004 110.273 178.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.94 -41.92 99.65 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.701 0.8 . . . . 73.219999999999999 111.639 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -77.66 -11.92 59.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.476 0.31 . . . . 65.049999999999997 111.757 174.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 9.5 m-30 -107.93 38.16 2.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.838 0.455 . . . . 71.140000000000001 109.797 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 C-N-CA 123.97 0.908 . . . . 73.219999999999999 109.075 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.2 ptp . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 110.338 -0.245 . . . . 64.340000000000003 110.338 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 76.47 49.33 8.25 Favored Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.543 -0.623 . . . . 74.310000000000002 111.543 -173.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 82.0 t60 -77.38 135.7 38.36 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.461 0.704 . . . . 72.209999999999994 110.075 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -110.52 160.41 16.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.583 0.753 . . . . 71.230000000000004 110.684 -177.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 62.6 t60 -118.73 39.31 3.53 Favored 'General case' 0 N--CA 1.479 0.984 0 N-CA-C 107.299 -1.371 . . . . 54.329999999999998 107.299 169.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 64.4 m80 73.54 -52.12 0.7 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.968 1.707 . . . . 72.340000000000003 111.873 -174.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.7 t60 62.01 27.86 16.88 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.568 1.147 . . . . 74.400000000000006 110.028 177.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -67.73 88.53 0.24 Allowed 'General case' 0 C--N 1.353 0.759 0 C-N-CA 124.428 1.091 . . . . 71.099999999999994 109.707 -175.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -152.87 165.52 35.2 Favored 'General case' 0 C--O 1.245 0.855 0 CA-C-N 114.142 -1.39 . . . . 72.219999999999999 108.604 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -52.98 150.39 5.59 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.751 0.82 . . . . 74.209999999999994 110.727 167.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -46.51 -37.97 8.64 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 124.956 1.302 . . . . 73.310000000000002 113.303 -171.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -99.77 95.81 4.12 Favored Pre-proline 0 CA--C 1.539 0.555 0 N-CA-C 107.469 -1.308 . . . . 53.32 107.469 171.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -61.28 -32.85 90.36 Favored 'Trans proline' 0 C--N 1.381 2.266 0 C-N-CA 122.893 2.395 . . . . 72.219999999999999 112.569 -171.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.556 ' HB3' HD23 ' A' ' 17' ' ' LEU . 31.5 t70 -151.54 105.77 3.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 114.86 -1.063 . . . . 64.439999999999998 108.711 -175.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' LEU . 4.8 mp -67.29 -21.85 65.67 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 122.851 0.461 . . . . 70.420000000000002 110.766 -178.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.48 -28.2 68.15 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.647 0.779 . . . . 62.049999999999997 110.999 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.689 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER -83.69 -21.77 32.27 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 110.09 -0.337 . . . . 72.239999999999995 110.09 175.104 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.7 -30.4 32.62 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 122.725 0.41 . . . . 74.540000000000006 110.614 -177.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.577 HG11 ' HG3' ' A' ' 45' ' ' ARG . 12.7 p -75.63 -29.51 20.73 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.827 -0.624 . . . . 74.109999999999999 111.413 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.689 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.4 ptpt -73.62 -31.58 63.61 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.824 -0.436 . . . . 74.430000000000007 109.824 176.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.04 -49.72 73.49 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.572 0.749 . . . . 75.510000000000005 110.429 177.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -71.52 -32.76 68.54 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.072 -0.513 . . . . 63.009999999999998 110.395 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -59.12 -36.79 90.13 Favored Glycine 0 C--N 1.348 1.221 0 O-C-N 123.401 0.438 . . . . 61.439999999999998 112.584 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -76.9 -36.32 56.75 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.484 0.713 . . . . 63.340000000000003 110.948 175.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -67.87 -30.16 69.45 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 109.826 -0.435 . . . . 74.420000000000002 109.826 -178.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.458 ' SG ' ' CD2' ' A' ' 38' ' ' HIS . 71.2 m -56.67 -39.47 73.8 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.838 0.711 . . . . 70.030000000000001 111.535 -179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.9 m-85 -56.68 -46.48 81.12 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.161 0.585 . . . . 51.509999999999998 110.364 173.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.64 -23.35 66.78 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.97 0.908 . . . . 73.230000000000004 111.061 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -83.51 -5.14 59.08 Favored 'General case' 0 N--CA 1.484 1.228 0 O-C-N 121.876 -0.515 . . . . 73.430000000000007 109.858 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.74 41.2 64.22 Favored Glycine 0 C--N 1.354 1.568 0 N-CA-C 110.89 -0.884 . . . . 34.219999999999999 110.89 -174.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -126.96 39.89 3.83 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.274 1.029 . . . . 53.530000000000001 108.722 -167.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -56.38 -48.55 96.8 Favored Pre-proline 0 CA--C 1.566 1.573 0 C-N-CA 124.969 1.307 . . . . 74.530000000000001 113.738 -172.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -61.45 -52.3 3.36 Favored 'Trans proline' 0 C--N 1.396 3.074 0 C-N-CA 121.498 1.465 . . . . 71.230000000000004 111.712 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -61.64 -26.5 68.04 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 116.006 -0.543 . . . . 75.439999999999998 110.892 178.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.75 -26.79 68.51 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.533 0.733 . . . . 53.539999999999999 111.461 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 65.2 mtm -69.14 -37.26 78.18 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 109.204 -0.665 . . . . 74.120000000000005 109.204 173.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -76.71 -30.13 56.53 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.443 1.097 . . . . 74.310000000000002 110.627 -178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.458 ' CD2' ' SG ' ' A' ' 26' ' ' CYS . 78.7 m-70 -69.54 -35.25 75.26 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.694 0.798 . . . . 74.299999999999997 109.205 173.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.83 -24.15 58.57 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 115.311 -0.859 . . . . 73.420000000000002 112.111 174.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 44.8 m -58.85 -46.25 88.15 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-N 118.917 0.78 . . . . 73.200000000000003 111.209 -176.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.5 pt-20 -69.71 -32.47 71.07 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 116.128 -0.487 . . . . 74.540000000000006 110.11 174.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -29.58 69.89 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.349 0.66 . . . . 74.129999999999995 112.377 -178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.8 mp -68.53 -38.27 78.91 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.036 0 N-CA-C 108.928 -0.767 . . . . 71.109999999999999 108.928 170.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -67.83 -27.75 66.97 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.92 0.488 . . . . 71.450000000000003 110.733 177.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.577 ' HG3' HG11 ' A' ' 19' ' ' VAL . 32.6 mmt180 -77.22 -57.0 4.08 Favored 'General case' 0 C--N 1.356 0.862 0 C-N-CA 123.089 0.556 . . . . 61.329999999999998 109.775 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -141.6 89.18 9.33 Favored Pre-proline 0 CA--C 1.561 1.401 0 C-N-CA 123.659 0.784 . . . . 70.340000000000003 111.579 -176.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -81.33 -2.57 11.68 Favored 'Trans proline' 0 C--N 1.367 1.532 0 C-N-CA 122.898 2.399 . . . . 73.120000000000005 113.73 -177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -87.29 -29.27 21.75 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.691 0.796 . . . . 74.019999999999996 109.872 -178.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.574 ' HB3' HD23 ' A' ' 52' ' ' LEU . 2.2 m-20 -69.53 98.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 114.681 -1.145 . . . . 73.540000000000006 110.637 -178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.648 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -64.3 -26.26 68.41 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.696 1.199 . . . . 72.540000000000006 112.928 -177.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -20.11 65.97 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.0 0.52 . . . . 51.030000000000001 111.904 178.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.574 HD23 ' HB3' ' A' ' 49' ' ' ASP . 3.8 mm? -67.76 -44.0 78.5 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.17 0.588 . . . . 64.540000000000006 110.109 171.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -76.49 -29.86 57.02 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.227 1.011 . . . . 73.420000000000002 111.416 -177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.1 p -68.48 -37.73 80.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.962 0.41 . . . . 75.109999999999999 111.265 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.6 m-20 -82.17 -22.93 35.81 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.555 -0.748 . . . . 73.129999999999995 110.539 178.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -67.44 -42.51 83.02 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.491 0.716 . . . . 63.140000000000001 109.186 171.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -66.66 -34.78 78.63 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.225 1.01 . . . . 62.32 111.094 173.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.23 -34.57 78.41 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.72 0.808 . . . . 63.409999999999997 111.284 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 42.2 t -68.99 -48.88 62.01 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.708 -0.678 . . . . 73.109999999999999 109.507 173.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -53.93 -40.57 66.87 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.846 0.858 . . . . 52.109999999999999 112.997 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 74.5 p -58.1 -42.17 85.12 Favored 'General case' 0 N--CA 1.481 1.092 0 CA-C-O 120.565 0.221 . . . . 72.510000000000005 110.854 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 29.8 mmmt -68.05 -29.61 68.62 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.405 0.682 . . . . 72.540000000000006 111.03 -177.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.7 mt -92.88 7.48 43.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.894 0.878 . . . . 73.219999999999999 110.965 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.402 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.8 mm? 67.36 15.08 9.86 Favored 'General case' 0 C--N 1.372 1.56 0 C-N-CA 124.136 0.974 . . . . 41.340000000000003 112.096 179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -91.64 42.85 1.12 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.286 1.434 . . . . 72.120000000000005 110.211 177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' HE1' HD13 ' A' ' 64' ' ' LEU . 75.5 m-85 -54.68 -33.16 60.46 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.17 0.988 . . . . 72.109999999999999 112.446 -177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 33.7 mm-40 -61.1 -37.74 83.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.186 0.594 . . . . 71.340000000000003 110.923 177.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 28.4 mt -76.37 -35.21 58.79 Favored 'General case' 0 C--N 1.351 0.64 0 CA-C-N 115.748 -0.66 . . . . 65.140000000000001 109.421 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.87 -37.8 88.33 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.936 0.894 . . . . 45.25 111.235 177.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 74' ' ' GLU . 97.6 mt -65.88 -61.62 1.96 Allowed 'General case' 0 C--N 1.356 0.876 0 O-C-N 123.573 0.546 . . . . 63.240000000000002 110.193 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt -62.26 -36.03 80.78 Favored 'General case' 0 N--CA 1.483 1.182 0 O-C-N 123.498 0.499 . . . . 72.409999999999997 112.095 -172.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -66.13 -37.3 85.37 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.264 0.626 . . . . 64.209999999999994 109.808 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HG ' ' HZ ' ' A' ' 83' ' ' PHE . 41.6 t -68.2 -34.56 76.5 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.016 0.926 . . . . 70.030000000000001 111.206 173.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 5.9 mm-40 -73.35 -24.25 60.32 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.508 0.559 . . . . 71.230000000000004 112.508 -177.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -90.89 -28.3 18.21 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.823 -0.548 . . . . 74.219999999999999 111.178 168.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.648 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 43.8 t -60.9 -33.58 73.35 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.63 0.772 . . . . 73.209999999999994 111.746 177.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.404 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -68.9 -31.48 50.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.181 0 C-N-CA 123.573 0.749 . . . . 71.140000000000001 110.312 173.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.404 HE21 HG23 ' A' ' 77' ' ' ILE . 28.1 mm-40 -75.22 -27.76 59.68 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 109.71 -0.478 . . . . 73.439999999999998 109.71 -177.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.9 mt -75.25 -62.48 1.55 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.178 0.591 . . . . 73.030000000000001 109.498 174.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -147.37 102.31 3.77 Favored Pre-proline 0 CA--C 1.549 0.913 0 CA-C-N 114.921 -1.036 . . . . 71.329999999999998 109.439 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.89 -0.52 9.58 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 123.199 2.6 . . . . 40.439999999999998 114.738 -175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 67.5 p -93.62 16.22 14.32 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 118.949 0.795 . . . . 64.200000000000003 111.702 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.401 ' HZ ' ' HG ' ' A' ' 73' ' ' CYS . 8.5 p90 -75.95 99.02 4.41 Favored 'General case' 0 CA--C 1.558 1.254 0 CA-C-O 122.834 1.302 . . . . 74.150000000000006 110.087 -177.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 63.9 mt -75.91 -34.54 27.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 115.405 -0.816 . . . . 72.299999999999997 110.526 -175.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.446 ' N ' ' HD2' ' A' ' 85' ' ' LYS . 3.2 mptp? -67.56 -13.77 62.35 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 114.757 -1.111 . . . . 73.299999999999997 111.706 -176.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -106.18 -28.4 5.24 Favored Glycine 0 C--N 1.349 1.304 0 CA-C-O 119.526 -0.596 . . . . 60.219999999999999 112.818 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -67.66 -39.87 84.51 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 117.222 0.511 . . . . 70.299999999999997 111.3 176.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.478 HG21 ' HG3' ' A' ' 119' ' ' GLU . 8.2 m -65.55 -29.4 70.02 Favored 'General case' 0 CA--C 1.558 1.265 0 CA-C-O 120.949 0.404 . . . . 63.240000000000002 110.626 177.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 8.7 mmp_? -74.08 -40.52 62.69 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.18 0.592 . . . . 72.150000000000006 110.094 173.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -64.98 -39.31 93.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.598 1.159 . . . . 71.230000000000004 110.783 -174.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.79 -48.67 75.99 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.259 0.624 . . . . 65.299999999999997 110.809 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -71.55 -24.68 61.98 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 123.178 0.591 . . . . 23.219999999999999 111.682 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -72.14 -46.79 55.1 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.387 -0.597 . . . . 64.439999999999998 109.387 175.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 82.2 mt -63.76 -31.3 72.43 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.681 0.792 . . . . 73.340000000000003 111.086 177.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -56.57 -40.46 75.23 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 122.786 0.435 . . . . 70.219999999999999 110.248 169.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.25 -0.61 41.5 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.216 0.606 . . . . 53.420000000000002 110.561 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 21.4 mmt -110.22 7.08 23.1 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.974 0.91 . . . . 71.150000000000006 110.414 175.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 67.66 9.59 7.18 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 124.962 1.305 . . . . 71.109999999999999 112.456 -177.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -93.56 45.92 1.18 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.863 1.265 . . . . 74.109999999999999 110.799 -177.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -50.08 -37.15 32.26 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.997 1.319 . . . . 65.549999999999997 112.868 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.6 p -65.76 -36.91 84.9 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.666 0.786 . . . . 74.25 111.54 177.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.441 ' O ' HG23 ' A' ' 106' ' ' VAL . 56.6 mmtt -80.67 -28.32 36.83 Favored 'General case' 0 N--CA 1.478 0.961 0 N-CA-C 109.513 -0.551 . . . . 75.120000000000005 109.513 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.4 -48.19 73.71 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.12 0.968 . . . . 34.140000000000001 110.064 177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 20.7 ptp -65.95 -25.85 67.31 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 115.467 -0.788 . . . . 65.540000000000006 111.4 -179.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -63.2 -42.38 99.31 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.611 -0.515 . . . . 62.240000000000002 109.611 170.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 102' ' ' LYS . 99.6 t -72.83 -33.12 42.87 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 C-N-CA 123.391 0.677 . . . . 61.310000000000002 110.262 -176.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.78 -50.97 71.31 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 124.529 1.132 . . . . 64.329999999999998 110.412 175.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -45.42 87.74 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 115.08 -0.963 . . . . 61.229999999999997 108.778 -176.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -64.32 -31.41 72.6 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.189 -0.914 . . . . 74.239999999999995 112.189 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.31 -47.44 79.43 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 109.55 -0.537 . . . . 74.439999999999998 109.55 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.795 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.3 mt -62.89 -31.18 72.19 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 123.63 0.581 . . . . 74.319999999999993 111.368 175.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -71.88 -23.14 61.45 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.179 0.991 . . . . 73.340000000000003 110.699 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 89.2 mt -75.6 -64.11 1.15 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 109.862 -0.421 . . . . 71.319999999999993 109.862 172.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -164.6 129.91 2.75 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 123.666 0.604 . . . . 74.310000000000002 109.775 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.457 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 22.2 m -54.52 -25.43 25.61 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.085 1.354 . . . . 75.129999999999995 113.874 -171.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.3 m -59.48 -6.48 1.08 Allowed 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.264 0.626 . . . . 64.010000000000005 112.635 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.795 ' SG ' HD23 ' A' ' 111' ' ' LEU . 27.6 p -79.56 13.61 1.96 Allowed 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.773 0.829 . . . . 74.030000000000001 113.017 169.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -45.86 -23.52 0.29 Allowed 'General case' 0 N--CA 1.508 2.458 0 N-CA-C 115.059 1.503 . . . . 74.310000000000002 115.059 177.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.478 ' HG3' HG21 ' A' ' 88' ' ' THR . 10.6 pt-20 -56.54 -32.89 65.57 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 71.409999999999997 111.779 173.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.18 -30.08 68.21 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.458 1.103 . . . . 72.019999999999996 111.458 172.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.92 -35.93 72.47 Favored 'General case' 0 C--N 1.365 1.245 0 C-N-CA 122.669 0.387 . . . . 74.099999999999994 110.756 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.3 -43.38 98.01 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.689 0.796 . . . . 73.140000000000001 110.106 172.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.19 -23.92 74.74 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 114.87 -1.059 . . . . 64.209999999999994 113.545 178.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -57.37 -58.24 9.11 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.767 0.427 . . . . 75.25 110.779 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -47.98 -40.91 23.81 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.306 1.004 . . . . 72.549999999999997 113.277 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.86 -22.1 31.79 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 112.408 0.521 . . . . 73.430000000000007 112.408 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 93.5 m -77.22 -47.3 20.58 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 117.902 0.319 . . . . 62.25 110.238 177.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.6 ptm -67.35 -46.31 73.75 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.133 0.573 . . . . 74.319999999999993 111.606 -177.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 25.1 ptm -64.07 -22.08 66.79 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 112.26 0.467 . . . . 73.329999999999998 112.26 -175.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -62.3 -32.91 73.71 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.28 1.032 . . . . 74.209999999999994 112.528 -174.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -87.64 -16.36 34.65 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.124 0.569 . . . . 75.430000000000007 111.684 176.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -100.84 37.94 1.63 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.242 0.617 . . . . 61.340000000000003 110.324 -173.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 17.7 m120 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 123.822 0.849 . . . . 74.019999999999996 110.049 -176.702 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.484 1.228 0 N-CA-C 109.694 -0.484 . . . . 72.430000000000007 109.694 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 103.78 37.23 3.03 Favored Glycine 0 C--N 1.346 1.138 0 CA-C-N 116.292 -0.413 . . . . 72.530000000000001 112.833 176.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.9 m170 -73.54 114.18 11.49 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 109.501 -0.555 . . . . 74.219999999999999 109.501 178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.5 t-80 -74.81 77.7 2.1 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.948 0.899 . . . . 65.310000000000002 109.15 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -128.97 5.99 5.43 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.29 1.036 . . . . 71.219999999999999 109.507 -179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -75.96 90.16 2.98 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.771 0.829 . . . . 71.5 109.974 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -97.72 -48.46 5.21 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 115.494 -0.775 . . . . 74.540000000000006 109.275 172.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.61 150.41 44.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.228 1.011 . . . . 74.319999999999993 109.001 -177.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.1 t -161.58 175.7 11.81 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.996 0.426 . . . . 61.229999999999997 110.573 -174.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -71.97 171.47 11.77 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.85 0.86 . . . . 74.040000000000006 111.38 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.6 mtt -55.62 -50.65 69.58 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 124.097 0.959 . . . . 62.450000000000003 109.952 -178.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -133.72 100.16 13.65 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 106.62 -1.622 . . . . 74.340000000000003 106.62 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -57.33 -33.01 95.42 Favored 'Trans proline' 0 C--N 1.38 2.206 0 C-N-CA 122.366 2.044 . . . . 63.020000000000003 111.056 176.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.525 ' HB3' HD23 ' A' ' 17' ' ' LEU . 20.1 t70 -153.79 108.16 3.07 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 107.543 -1.281 . . . . 64.230000000000004 107.543 175.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.503 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.4 mp -57.5 -31.39 65.98 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.394 0.677 . . . . 74.140000000000001 110.207 178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.0 -21.3 65.96 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.367 1.067 . . . . 75.0 112.981 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.62 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.9 OUTLIER -78.35 -21.31 49.7 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 109.608 -0.516 . . . . 72.209999999999994 109.608 176.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.2 mmt -77.47 -34.42 54.34 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 122.829 0.451 . . . . 72.439999999999998 110.578 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.482 HG11 ' HG3' ' A' ' 45' ' ' ARG . 13.8 p -77.69 -25.06 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 C-N-CA 123.135 0.574 . . . . 71.420000000000002 111.865 -178.091 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.62 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.0 ptpt -77.89 -22.04 50.36 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.925 -0.485 . . . . 65.150000000000006 110.614 176.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -66.7 -43.21 84.97 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.337 0.655 . . . . 61.210000000000001 110.521 177.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -78.21 -35.24 48.76 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.407 -0.361 . . . . 64.109999999999999 110.172 174.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.401 ' HA2' ' HB3' ' A' ' 38' ' ' HIS . . . -55.39 -53.41 41.14 Favored Glycine 0 C--N 1.352 1.447 0 O-C-N 123.891 0.744 . . . . 64.319999999999993 114.04 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -73.38 -27.1 61.29 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 112.282 0.475 . . . . 44.119999999999997 112.282 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 3.1 pt-20 -73.9 -34.8 64.55 Favored 'General case' 0 C--N 1.353 0.745 0 CA-C-O 118.692 -0.671 . . . . 75.409999999999997 109.75 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.446 ' SG ' ' ND1' ' A' ' 38' ' ' HIS . 72.4 m -50.0 -44.52 51.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.491 0.716 . . . . 72.140000000000001 111.443 179.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.5 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 33.8 t80 -57.16 -47.88 80.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.049 0.94 . . . . 73.040000000000006 110.243 177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -63.73 -25.34 68.15 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.696 1.198 . . . . 65.230000000000004 111.242 175.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.7 mmmt -78.16 -10.24 59.54 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 121.868 -0.52 . . . . 72.120000000000005 110.218 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 95.31 3.2 61.63 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.164 -0.471 . . . . 65.299999999999997 112.278 -176.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 6.0 m-20 -92.44 80.23 4.91 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.787 0.835 . . . . 72.439999999999998 109.328 176.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -67.09 -49.08 47.51 Favored Pre-proline 0 CA--C 1.566 1.592 0 CA-C-O 118.266 -0.873 . . . . 71.540000000000006 112.15 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.12 -47.6 4.47 Favored 'Trans proline' 0 C--N 1.397 3.081 0 C-N-CA 121.468 1.446 . . . . 60.25 111.448 176.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.652 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 37.7 mm-40 -59.98 -33.37 71.87 Favored 'General case' 0 C--N 1.36 1.062 0 CA-C-O 119.282 -0.39 . . . . 73.209999999999994 110.753 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.0 -41.92 88.85 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 123.575 0.547 . . . . 70.140000000000001 110.325 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -70.68 -37.42 73.64 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 124.124 0.89 . . . . 73.099999999999994 109.269 -175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.28 -39.77 82.01 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.662 0.785 . . . . 74.430000000000007 110.727 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.446 ' ND1' ' SG ' ' A' ' 26' ' ' CYS . 18.2 m170 -76.58 -20.8 56.43 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-N 115.135 -0.939 . . . . 71.140000000000001 110.911 -177.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -77.58 -38.78 47.6 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.227 0.611 . . . . 75.510000000000005 110.338 167.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.9 m -64.68 -43.29 94.0 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.958 0.503 . . . . 75.140000000000001 111.088 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 13.9 pt-20 -66.99 -31.09 71.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.926 0.49 . . . . 74.109999999999999 109.96 175.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.27 -30.44 67.48 Favored 'General case' 0 C--N 1.352 0.688 0 C-N-CA 123.153 0.581 . . . . 72.109999999999999 111.388 176.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.45 -34.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 123.57 0.748 . . . . 71.310000000000002 110.008 174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.9 mmtt -66.63 -35.54 80.41 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.231 0.613 . . . . 60.43 109.903 178.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HG3' HG11 ' A' ' 19' ' ' VAL . 35.9 mmt180 -78.83 -50.19 11.69 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.001 -0.999 . . . . 75.430000000000007 110.892 -176.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -122.33 86.43 47.98 Favored Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 123.475 0.71 . . . . 74.439999999999998 111.93 176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.01 -12.16 31.91 Favored 'Trans proline' 0 C--N 1.373 1.84 0 C-N-CA 121.956 1.771 . . . . 73.040000000000006 112.134 169.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -76.15 -33.01 59.38 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.77 0.828 . . . . 75.209999999999994 110.423 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -80.85 100.39 8.81 Favored 'General case' 0 C--N 1.351 0.661 0 C-N-CA 123.501 0.721 . . . . 75.040000000000006 110.709 -169.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.41 78.02 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.609 1.163 . . . . 62.43 113.889 -170.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.08 -21.18 64.98 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-N 118.399 0.545 . . . . 64.019999999999996 111.329 -176.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -62.4 -28.56 69.87 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.556 0.742 . . . . 65.450000000000003 110.97 179.311 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.7 m-85 -75.02 -46.52 34.51 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.582 0.753 . . . . 73.129999999999995 110.472 175.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.2 p -66.88 -20.84 65.99 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.728 0.411 . . . . 73.010000000000005 111.555 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -69.54 -35.38 75.39 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 123.635 0.774 . . . . 70.129999999999995 110.81 171.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -69.01 -40.2 78.82 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 109.725 -0.472 . . . . 71.150000000000006 109.725 173.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -60.49 -36.98 79.62 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.465 0.706 . . . . 61.340000000000003 110.828 175.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.56 -31.42 72.12 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.791 0.836 . . . . 62.450000000000003 111.609 175.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 77.4 m -73.31 -46.66 48.28 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 122.591 0.356 . . . . 73.400000000000006 110.389 173.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 69' ' ' ALA . 18.7 m-85 -56.75 -36.78 70.18 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.231 1.012 . . . . 71.530000000000001 111.841 -174.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 76.2 p -58.55 -44.15 89.56 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.75 0.42 . . . . 72.25 110.63 175.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -70.75 -28.82 64.98 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.681 0.792 . . . . 75.109999999999999 110.805 -178.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 66.2 mt -86.75 0.36 54.86 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.248 -0.887 . . . . 62.43 110.751 176.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 66.6 14.29 9.69 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.672 1.189 . . . . 74.329999999999998 112.116 179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -94.88 49.02 1.21 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 125.384 1.473 . . . . 70.439999999999998 110.192 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -55.02 -26.0 34.19 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.795 0.838 . . . . 71.239999999999995 111.531 177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -55.23 -44.87 75.88 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.761 0.824 . . . . 63.399999999999999 110.331 174.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 29.7 mt -75.58 -35.57 60.55 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 115.368 -0.833 . . . . 74.219999999999999 110.009 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 60' ' ' TYR . . . -63.13 -36.32 83.23 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.53 0.732 . . . . 52.329999999999998 111.887 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.0 mt -68.17 -60.08 2.74 Favored 'General case' 0 C--N 1.349 0.569 0 C-N-CA 123.065 0.546 . . . . 63.539999999999999 110.066 177.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -67.08 -32.69 74.03 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 112.778 0.659 . . . . 75.530000000000001 112.778 -172.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -67.32 -34.06 76.56 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.978 0.511 . . . . 74.140000000000001 110.3 177.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 54.0 t -80.18 -29.31 38.67 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.278 0.631 . . . . 75.420000000000002 110.904 175.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.405 ' O ' HG22 ' A' ' 77' ' ' ILE . 58.8 mm-40 -70.18 -29.94 66.94 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.184 0.594 . . . . 73.340000000000003 111.248 176.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -88.67 -32.98 17.75 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.401 0.281 . . . . 73.030000000000001 111.014 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.9 t -60.83 -25.8 66.88 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.16 0.584 . . . . 74.409999999999997 111.926 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -62.86 -25.37 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.302 0 C-N-CA 123.993 0.917 . . . . 61.32 110.49 178.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -67.19 -27.56 67.37 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.231 0.612 . . . . 71.239999999999995 110.832 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.1 mt -92.8 -34.77 13.73 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.581 0.752 . . . . 54.030000000000001 111.113 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -148.32 106.67 3.58 Favored Pre-proline 0 N--CA 1.473 0.724 0 C-N-CA 122.53 0.332 . . . . 70.040000000000006 111.312 -175.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -76.35 -16.22 17.43 Favored 'Trans proline' 0 C--N 1.366 1.483 0 C-N-CA 121.873 1.715 . . . . 63.100000000000001 113.367 172.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 76.9 p -111.97 19.7 17.63 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 113.942 1.09 . . . . 73.230000000000004 113.942 -172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -65.04 127.15 30.43 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 119.485 1.038 . . . . 75.040000000000006 110.886 175.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.6 HG23 ' SG ' ' A' ' 117' ' ' CYS . 54.5 mt -83.46 -53.72 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 123.514 0.725 . . . . 74.549999999999997 110.289 -178.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -60.62 -33.04 72.17 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.387 0.675 . . . . 74.420000000000002 111.854 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.6 -48.64 70.75 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 123.582 0.551 . . . . 60.229999999999997 112.3 175.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.1 m-30 -66.47 -28.82 68.88 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.138 0.575 . . . . 64.099999999999994 112.289 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.482 HG22 HH21 ' A' ' 89' ' ' ARG . 32.3 m -64.56 -39.69 94.2 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.286 0.634 . . . . 72.030000000000001 110.199 175.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.482 HH21 HG22 ' A' ' 88' ' ' THR . 3.6 mmp_? -84.73 -27.03 27.24 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.518 0.727 . . . . 73.420000000000002 111.829 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -76.27 -47.76 22.62 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.43 0.692 . . . . 72.200000000000003 110.662 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.518 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -68.25 -32.43 72.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.365 0.666 . . . . 70.120000000000005 110.919 176.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.85 -37.78 88.77 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.028 -0.533 . . . . 64.120000000000005 110.746 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.71 79.3 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 122.804 0.442 . . . . 75.040000000000006 110.36 176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.3 mt -59.57 -38.04 80.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.619 0.768 . . . . 75.430000000000007 110.959 176.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.07 -36.58 73.03 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 71.5 110.343 173.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.26 -8.66 59.56 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 122.972 0.509 . . . . 73.140000000000001 110.506 -178.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 25.4 mmt -102.97 7.75 39.1 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.908 0.883 . . . . 54.229999999999997 109.842 173.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 68.34 9.3 7.16 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 125.234 1.414 . . . . 75.340000000000003 112.205 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -86.6 50.16 1.95 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.501 1.12 . . . . 73.340000000000003 110.929 -177.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -51.59 -34.18 35.97 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.886 1.274 . . . . 73.319999999999993 113.211 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 63.0 p -68.73 -34.23 75.27 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.505 0.722 . . . . 61.100000000000001 111.283 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 106' ' ' VAL . 62.3 mmtt -80.91 -34.45 33.42 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.631 -0.507 . . . . 70.530000000000001 109.631 177.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.74 -53.89 44.01 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 123.893 0.877 . . . . 52.450000000000003 110.591 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 15.8 ptp -58.96 -29.64 67.31 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.712 0.805 . . . . 73.25 111.978 -178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.455 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 12.0 t70 -65.72 -42.15 91.41 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 124.133 0.895 . . . . 64.299999999999997 109.147 176.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.518 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 95.2 t -75.53 -33.96 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 C-N-CA 123.813 0.845 . . . . 71.209999999999994 110.274 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.631 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 35.3 m-85 -64.83 -42.48 94.9 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 123.358 0.663 . . . . 75.450000000000003 110.384 174.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.28 -48.16 82.67 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 108.851 -0.796 . . . . 72.430000000000007 108.851 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.558 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 33.0 mmmt -61.21 -41.6 97.12 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.97 0.793 . . . . 75.519999999999996 111.061 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.631 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -61.7 -46.37 90.0 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.005 0.922 . . . . 72.439999999999998 111.325 178.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.469 HD21 ' HB2' ' A' ' 121' ' ' ALA . 85.4 mt -62.04 -37.23 84.16 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.201 1.0 . . . . 73.239999999999995 111.116 174.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -69.39 -28.11 65.88 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.246 1.018 . . . . 75.439999999999998 110.967 -177.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 85.1 mt -64.29 -51.15 64.94 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.36 0.664 . . . . 65.219999999999999 110.083 176.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -162.91 138.99 7.16 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.223 -0.899 . . . . 75.040000000000006 109.535 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.487 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 34.2 m -59.67 -35.77 75.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.827 0.851 . . . . 70.25 112.062 -175.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 39.3 t -63.55 -4.56 2.96 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.617 0.767 . . . . 74.230000000000004 112.461 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.631 ' SG ' ' HB1' ' A' ' 110' ' ' ALA . 38.8 t -78.83 13.96 1.52 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.221 0.608 . . . . 72.230000000000004 111.56 169.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.487 ' HG2' ' O ' ' A' ' 115' ' ' SER . 14.1 mmmm -46.46 -27.11 1.0 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 113.593 0.96 . . . . 73.409999999999997 113.593 170.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -47.6 -38.3 14.28 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.761 1.224 . . . . 63.340000000000003 112.247 171.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB1' ' HD1' ' A' ' 107' ' ' TYR . . . -81.07 -22.52 39.19 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.836 1.254 . . . . 61.539999999999999 111.304 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.469 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -67.35 -39.43 85.76 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.882 -0.414 . . . . 70.230000000000004 109.882 175.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.75 -47.11 85.77 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.215 0.606 . . . . 74.200000000000003 110.559 172.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.06 -35.1 86.43 Favored Glycine 0 C--N 1.349 1.28 0 CA-C-N 115.856 -0.611 . . . . 53.539999999999999 112.605 176.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -62.62 -50.5 70.99 Favored 'General case' 0 C--N 1.354 0.773 0 C-N-CA 123.936 0.894 . . . . 74.230000000000004 110.95 176.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -46.48 -39.81 11.35 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 124.297 0.998 . . . . 75.409999999999997 112.011 -178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -74.51 -40.2 61.94 Favored 'General case' 0 CA--C 1.545 0.785 0 O-C-N 123.969 0.793 . . . . 72.540000000000006 111.206 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.631 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 95.4 m -67.94 -44.32 77.09 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 122.859 0.464 . . . . 72.150000000000006 111.857 -174.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.1 ptm -65.79 -45.72 81.36 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 115.923 -0.581 . . . . 71.319999999999993 110.821 178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 22.2 ptm -74.06 -15.95 61.05 Favored 'General case' 0 C--N 1.357 0.913 0 CA-C-O 119.415 -0.326 . . . . 70.099999999999994 111.19 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -71.29 -38.16 71.81 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.439 0.695 . . . . 51.520000000000003 111.785 -177.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -82.71 -27.26 31.3 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 116.498 -0.319 . . . . 73.420000000000002 110.772 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 8.4 m-30 -100.05 37.47 1.64 Allowed 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 109.067 -0.716 . . . . 74.219999999999999 109.067 178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 C--O 1.251 1.14 0 C-N-CA 123.068 0.547 . . . . 62.43 110.682 -169.77 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtt . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.693 -0.484 . . . . 75.239999999999995 109.693 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 68.86 57.79 7.51 Favored Glycine 0 C--N 1.351 1.414 0 O-C-N 123.529 0.518 . . . . 65.120000000000005 112.607 178.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 t60 -73.99 145.31 44.7 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.435 0.694 . . . . 73.329999999999998 109.505 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 m-70 59.04 60.48 2.41 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 108.401 -0.963 . . . . 73.239999999999995 108.401 -161.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 37.5 t60 -76.33 89.77 3.18 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 114.547 -1.206 . . . . 75.400000000000006 109.834 -174.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -66.72 99.33 0.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 123.721 0.808 . . . . 72.150000000000006 110.648 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -137.14 81.77 1.89 Allowed 'General case' 0 C--N 1.348 0.507 0 C-N-CA 123.865 0.866 . . . . 71.439999999999998 109.061 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 63.4 m80 -137.79 -160.21 1.04 Allowed 'General case' 0 C--O 1.245 0.842 0 N-CA-C 106.895 -1.52 . . . . 75.329999999999998 106.895 171.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -65.82 82.72 0.07 Allowed 'General case' 0 CA--C 1.548 0.897 0 N-CA-C 109.389 -0.597 . . . . 70.439999999999998 109.389 170.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -74.01 99.11 3.21 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.158 0.983 . . . . 63.229999999999997 110.894 -172.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 mtm -59.6 -38.49 81.39 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 115.016 -0.993 . . . . 74.219999999999999 110.516 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -70.11 109.89 5.69 Favored Pre-proline 0 N--CA 1.475 0.798 0 N-CA-C 108.126 -1.065 . . . . 74.030000000000001 108.126 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -56.94 -41.05 79.41 Favored 'Trans proline' 0 C--N 1.377 2.064 0 C-N-CA 123.08 2.52 . . . . 72.329999999999998 112.033 -177.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.5 ' HB3' HD23 ' A' ' 17' ' ' LEU . 17.6 t70 -162.35 112.72 1.52 Allowed 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 108.202 -1.036 . . . . 73.340000000000003 108.202 177.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.432 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.6 mp -60.25 -30.72 69.61 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.246 0.618 . . . . 75.549999999999997 111.076 -179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.53 -20.54 66.38 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-N 115.276 -0.874 . . . . 73.140000000000001 112.945 177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.636 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -82.16 -19.95 38.92 Favored 'General case' 0 N--CA 1.48 1.025 0 CA-C-N 117.781 0.264 . . . . 72.540000000000006 110.329 176.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 18.8 mmt -73.9 -35.27 64.64 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.376 0.608 . . . . 62.450000000000003 110.33 -175.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.1 p -77.49 -25.74 15.04 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.191 -0.913 . . . . 61.310000000000002 111.761 -176.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 16.4 ptpt -77.35 -24.06 50.78 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 121.658 -0.651 . . . . 75.430000000000007 110.121 175.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -66.06 -49.81 66.34 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.478 0.711 . . . . 73.019999999999996 110.718 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -24.51 63.3 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-N 116.509 -0.314 . . . . 73.319999999999993 110.248 177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.77 -57.37 14.53 Favored Glycine 0 C--N 1.354 1.565 0 CA-C-N 115.822 -0.626 . . . . 64.319999999999993 112.116 175.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-20 -60.52 -33.79 73.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.898 0.879 . . . . 72.219999999999999 111.068 178.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 7.4 tt0 -68.83 -56.09 9.08 Favored 'General case' 0 C--N 1.351 0.672 0 C-N-CA 123.843 0.857 . . . . 75.25 111.264 -179.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 97.8 m -59.03 -43.72 91.64 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.312 0.486 . . . . 70.030000000000001 112.312 -174.344 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.5 t80 -59.59 -41.28 89.95 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-N 116.077 -0.511 . . . . 75.439999999999998 110.442 176.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -66.11 -23.05 66.43 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 124.496 1.118 . . . . 73.019999999999996 111.289 176.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 25.6 mmmt -79.13 -6.81 57.38 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 110.0 -0.37 . . . . 74.349999999999994 110.0 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.17 27.92 7.52 Favored Glycine 0 C--N 1.35 1.325 0 CA-C-N 116.037 -0.529 . . . . 72.140000000000001 112.159 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.671 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 5.5 m-20 -105.23 89.47 3.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.417 0.687 . . . . 72.310000000000002 110.167 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -81.7 -49.04 0.96 Allowed Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.991 0.916 . . . . 73.140000000000001 111.81 -176.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.9 -44.37 4.11 Favored 'Trans proline' 0 C--N 1.392 2.841 0 CA-C-N 120.916 1.363 . . . . 65.109999999999999 111.481 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.671 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 29.6 mm-40 -59.91 -23.85 63.83 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.525 0.73 . . . . 75.299999999999997 111.735 176.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -61.85 -40.49 95.5 Favored 'General case' 0 C--N 1.354 0.793 0 N-CA-C 112.198 0.444 . . . . 54.310000000000002 112.198 172.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 53.4 ttp -63.04 -32.58 73.98 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-O 121.034 0.445 . . . . 64.450000000000003 110.007 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -83.44 -45.47 13.62 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 115.497 -0.774 . . . . 70.549999999999997 112.403 -176.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.625 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 1.0 OUTLIER -71.45 -19.19 62.26 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 120.643 0.259 . . . . 75.340000000000003 111.573 -176.323 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.92 -24.03 33.25 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 119.373 -0.346 . . . . 63.299999999999997 111.248 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 75.0 m -66.79 -45.5 78.21 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-N 118.139 0.427 . . . . 72.319999999999993 110.956 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -65.46 -28.86 69.52 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 122.699 0.4 . . . . 62.420000000000002 110.685 174.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.99 -36.33 72.45 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 123.281 0.632 . . . . 34.340000000000003 111.33 177.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.23 -36.75 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 124.02 0.928 . . . . 64.519999999999996 110.316 174.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -66.86 -21.59 66.01 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 115.459 -0.791 . . . . 70.25 111.85 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -93.47 -48.78 6.23 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 123.571 0.748 . . . . 61.329999999999998 110.505 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.53 ' HB2' ' HB2' ' A' ' 49' ' ' ASP . 0.3 OUTLIER -124.28 80.37 59.28 Favored Pre-proline 0 N--CA 1.482 1.138 0 C-N-CA 123.782 0.833 . . . . 72.310000000000002 110.961 179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.72 1.95 7.51 Favored 'Trans proline' 0 C--N 1.376 1.993 0 C-N-CA 122.809 2.339 . . . . 72.209999999999994 113.242 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.6 mptt -100.83 -19.7 15.84 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.449 0.7 . . . . 74.530000000000001 110.627 176.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.53 ' HB2' ' HB2' ' A' ' 46' ' ' ASN . 1.4 t0 -82.24 98.71 8.89 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 122.818 0.447 . . . . 54.340000000000003 110.776 -167.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.74 -44.34 77.49 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.5 1.52 . . . . 72.109999999999999 113.514 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -27.62 68.32 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-N 117.654 0.206 . . . . 72.230000000000004 111.441 -175.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.479 ' HG ' HD21 ' A' ' 46' ' ' ASN . 3.5 mm? -67.35 -35.11 78.72 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.498 0.719 . . . . 64.140000000000001 111.055 178.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -68.13 -51.03 50.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 115.87 -0.604 . . . . 64.239999999999995 109.393 170.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.8 t -59.85 -21.35 60.84 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.794 1.238 . . . . 64.150000000000006 112.777 -178.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -68.05 -36.39 79.81 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.469 0.708 . . . . 44.439999999999998 110.724 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -66.79 -39.68 87.85 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.256 0.622 . . . . 71.239999999999995 109.405 175.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.97 -39.63 95.26 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.318 0.647 . . . . 43.039999999999999 111.522 173.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.23 -29.34 69.57 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.708 0.803 . . . . 64.109999999999999 111.148 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 81.8 m -70.79 -51.84 24.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 109.41 -0.589 . . . . 62.240000000000002 109.41 170.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.4 m-85 -57.13 -39.38 75.03 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.951 0.9 . . . . 75.140000000000001 112.398 -174.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.7 p -60.53 -44.34 96.17 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 123.524 0.515 . . . . 75.140000000000001 110.3 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -70.5 -25.88 63.34 Favored 'General case' 0 C--N 1.355 0.847 0 C-N-CA 123.825 0.85 . . . . 74.219999999999999 110.548 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 82.4 mt -90.26 -2.58 58.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.37 -0.832 . . . . 75.530000000000001 110.576 179.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.431 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.7 mm? 72.86 8.12 5.49 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.668 1.187 . . . . 71.209999999999994 111.808 -179.092 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.88 54.61 3.24 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 124.403 1.081 . . . . 74.040000000000006 110.293 174.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.467 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 66.4 m-85 -60.46 -27.16 67.32 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.71 0.804 . . . . 62.340000000000003 112.408 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -59.6 -38.26 80.78 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.174 0.589 . . . . 64.239999999999995 110.315 174.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.2 mt -77.75 -34.02 52.62 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-N 115.429 -0.805 . . . . 73.349999999999994 109.562 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.8 -31.71 72.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.437 0.695 . . . . 65.530000000000001 111.426 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.51 HD11 ' HG3' ' A' ' 97' ' ' MET . 96.1 mt -62.33 -63.36 1.26 Allowed 'General case' 0 C--N 1.357 0.903 0 C-N-CA 123.075 0.55 . . . . 74.010000000000005 109.624 173.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -62.84 -32.07 73.21 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.783 0.677 . . . . 64.219999999999999 112.162 -174.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -64.91 -45.04 87.57 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.483 0.713 . . . . 71.420000000000002 110.293 176.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.514 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 48.4 t -70.6 -28.6 64.98 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 116.078 -0.51 . . . . 65.439999999999998 110.707 176.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.441 ' O ' ' HG2' ' A' ' 78' ' ' GLN . 47.9 mt-10 -71.05 -29.16 64.99 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.229 0.611 . . . . 64.400000000000006 111.63 179.628 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -83.82 -39.11 20.37 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.22 0.464 . . . . 64.400000000000006 110.008 173.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 45.8 t -58.04 -35.42 71.29 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.005 0.922 . . . . 75.200000000000003 112.141 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.468 HG23 HE21 ' A' ' 78' ' ' GLN . 0.0 OUTLIER -78.99 -22.04 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.154 0 C-N-CA 123.307 0.643 . . . . 72.219999999999999 110.251 179.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.468 HE21 HG23 ' A' ' 77' ' ' ILE . 27.7 mm-40 -80.6 -25.4 38.48 Favored 'General case' 0 N--CA 1.483 1.179 0 O-C-N 121.586 -0.696 . . . . 72.150000000000006 110.048 175.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.73 -53.8 9.53 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.345 0.658 . . . . 74.430000000000007 109.583 172.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -136.97 95.57 12.0 Favored Pre-proline 0 CA--C 1.548 0.887 0 CA-C-N 114.422 -1.263 . . . . 73.340000000000003 109.34 -176.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.87 -14.36 29.57 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.757 2.305 . . . . 71.329999999999998 113.572 177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 81.5 p -97.46 13.9 28.27 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 122.336 -0.227 . . . . 71.310000000000002 110.808 174.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.0 t80 -76.36 95.31 3.77 Favored 'General case' 0 C--N 1.358 0.962 0 N-CA-C 108.968 -0.753 . . . . 71.450000000000003 108.968 172.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.465 ' CG2' ' SG ' ' A' ' 117' ' ' CYS . 67.1 mt -60.27 -50.16 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 113.733 -1.576 . . . . 72.239999999999995 113.054 -168.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -84.67 2.39 41.93 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.017 0.377 . . . . 64.319999999999993 112.017 -173.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.32 -33.39 56.64 Favored Glycine 0 C--N 1.353 1.488 0 N-CA-C 110.629 -0.989 . . . . 54.229999999999997 110.629 162.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' ILE . 4.8 m-85 -63.44 -35.12 79.38 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.633 0.773 . . . . 73.319999999999993 110.701 171.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 23.7 m -65.95 -38.57 88.95 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 122.987 0.515 . . . . 64.150000000000006 110.671 176.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -65.77 -45.37 82.75 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-O 121.569 0.7 . . . . 73.519999999999996 110.03 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.514 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 25.4 tptp -64.07 -52.77 57.74 Favored 'General case' 0 C--N 1.35 0.594 0 CA-C-N 113.944 -1.48 . . . . 73.239999999999995 110.531 -172.166 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.17 -37.21 82.09 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.995 0.809 . . . . 75.420000000000002 111.943 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -42.77 96.4 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 123.792 0.682 . . . . 62.399999999999999 111.315 177.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -67.73 -43.43 80.0 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.927 -0.578 . . . . 73.439999999999998 110.812 176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.503 HD13 ' HB2' ' A' ' 102' ' ' LYS . 96.4 mt -60.68 -36.18 78.12 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.159 0.983 . . . . 71.329999999999998 111.49 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -62.72 -31.38 72.29 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.488 0.715 . . . . 65.109999999999999 110.744 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -85.42 -5.7 59.28 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.862 -0.608 . . . . 53.229999999999997 110.773 176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.51 ' HG3' HD11 ' A' ' 70' ' ' LEU . 17.4 mmt -115.82 8.43 14.81 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.749 0.819 . . . . 62.130000000000003 111.352 -178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 69.79 9.08 7.02 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.786 1.234 . . . . 74.329999999999998 112.388 178.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -86.97 39.84 0.88 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.578 1.151 . . . . 71.219999999999999 111.376 -177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -53.55 -32.94 52.81 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.351 1.06 . . . . 75.530000000000001 112.055 178.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 44.3 p -60.24 -39.96 88.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 124.726 1.266 . . . . 74.439999999999998 110.903 176.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.503 ' HB2' HD13 ' A' ' 94' ' ' LEU . 18.4 mmtp -77.04 -44.78 29.48 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.196 -0.668 . . . . 64.319999999999993 109.196 176.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 -40.39 83.89 Favored 'General case' 0 C--N 1.349 0.547 0 CA-C-N 114.771 -1.104 . . . . 73.200000000000003 112.36 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 18.3 ptp -65.22 -27.19 68.5 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.869 0.468 . . . . 73.239999999999995 111.838 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -82.09 -23.94 35.46 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 61.539999999999999 110.74 173.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 102' ' ' LYS . 92.0 t -80.86 -35.26 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 CA-C-O 121.45 0.643 . . . . 71.140000000000001 109.397 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.36 -42.33 83.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.691 1.197 . . . . 71.0 109.378 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.88 -49.54 75.82 Favored 'General case' 0 C--N 1.354 0.781 0 CA-C-N 114.798 -1.092 . . . . 72.510000000000005 108.485 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.486 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 30.0 mmmt -61.17 -35.43 77.11 Favored 'General case' 0 C--N 1.348 0.528 0 O-C-N 124.115 0.884 . . . . 72.349999999999994 112.66 175.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.02 -48.41 81.84 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 109.902 -0.407 . . . . 74.140000000000001 109.902 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.64 -33.73 76.57 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.182 0.593 . . . . 71.329999999999998 111.851 175.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.446 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 31.2 t70 -69.02 -26.92 65.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.835 1.254 . . . . 72.099999999999994 110.132 -177.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.6 mt -82.14 -45.11 15.6 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.428 0.691 . . . . 65.319999999999993 109.485 170.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.42 ' HB3' HD13 ' A' ' 84' ' ' ILE . 6.6 t70 -158.35 126.86 5.42 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.54 0.736 . . . . 75.329999999999998 111.98 -173.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.8 p -61.26 -35.12 76.41 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.977 0.911 . . . . 51.049999999999997 111.729 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.1 t -68.62 3.71 1.73 Allowed 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.19 0.596 . . . . 74.219999999999999 112.229 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.465 ' SG ' ' CG2' ' A' ' 84' ' ' ILE . 44.9 m -76.37 14.23 0.79 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.364 0.666 . . . . 73.329999999999998 111.906 165.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -40.81 -25.34 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 114.654 1.353 . . . . 73.0 114.654 165.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -48.81 -41.73 33.69 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.554 1.142 . . . . 74.239999999999995 112.061 170.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -82.41 -19.86 38.23 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.36 1.064 . . . . 63.009999999999998 111.119 178.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -70.05 -41.45 74.18 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 122.755 0.422 . . . . 53.439999999999998 110.264 179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -59.83 -50.17 74.83 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.962 0.789 . . . . 64.530000000000001 109.983 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -64.34 -29.01 73.85 Favored Glycine 0 C--N 1.355 1.608 0 CA-C-N 115.108 -0.951 . . . . 65.310000000000002 113.629 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -57.04 -48.88 77.45 Favored 'General case' 0 C--N 1.355 0.838 0 C-N-CA 123.544 0.738 . . . . 74.329999999999998 112.588 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.83 -37.58 14.11 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 124.302 1.001 . . . . 65.409999999999997 112.199 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.417 ' HA ' ' HG2' ' A' ' 129' ' ' MET . 50.3 ttp180 -79.25 -35.18 41.9 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 122.754 0.422 . . . . 71.129999999999995 111.088 176.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 84.9 m -65.03 -52.62 54.89 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.839 0.456 . . . . 73.150000000000006 110.451 -175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 22.0 ptm -62.22 -50.38 72.0 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 115.916 -0.584 . . . . 63.409999999999997 111.238 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 126' ' ' ARG . 11.2 ptt? -64.69 -28.25 69.47 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.418 0.287 . . . . 71.150000000000006 111.564 -174.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -55.68 -51.09 68.44 Favored 'General case' 0 C--N 1.355 0.836 0 C-N-CA 123.817 0.847 . . . . 65.129999999999995 111.782 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.47 -27.58 62.38 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 123.673 0.608 . . . . 74.319999999999993 111.34 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -96.41 34.86 1.55 Allowed 'General case' 0 N--CA 1.486 1.353 0 CA-C-N 118.048 0.385 . . . . 75.140000000000001 111.217 -178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 . . . . . 0 C--O 1.252 1.189 0 C-N-CA 123.821 0.849 . . . . 72.420000000000002 108.973 175.574 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mmt . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 109.453 -0.573 . . . . 73.150000000000006 109.453 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -136.28 -153.3 6.52 Favored Glycine 0 C--N 1.342 0.887 0 N-CA-C 110.797 -0.921 . . . . 50.43 110.797 174.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -99.88 141.71 32.33 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 117.152 0.476 . . . . 74.409999999999997 110.999 -177.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -85.47 -16.85 38.27 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 65.420000000000002 110.526 175.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -64.23 86.59 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.483 0.713 . . . . 75.040000000000006 110.276 178.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -139.16 29.01 2.26 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.798 1.239 . . . . 60.100000000000001 109.426 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -85.48 46.16 1.27 Allowed 'General case' 0 N--CA 1.48 1.058 0 CA-C-O 121.886 0.85 . . . . 75.150000000000006 110.29 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.6 m170 -146.01 34.05 1.01 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.929 1.692 . . . . 73.25 107.572 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 m -64.9 107.39 1.46 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.68 0.792 . . . . 72.129999999999995 110.333 179.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -75.7 -168.04 0.79 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.124 0.97 . . . . 73.340000000000003 111.151 178.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.7 mmt -49.28 -49.52 43.21 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.017 0.927 . . . . 70.049999999999997 110.473 175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -93.3 111.04 50.26 Favored Pre-proline 0 C--O 1.241 0.608 0 N-CA-C 107.403 -1.332 . . . . 61.200000000000003 107.403 161.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.531 ' HG2' HD21 ' A' ' 17' ' ' LEU . 28.0 Cg_endo -61.28 -30.45 88.02 Favored 'Trans proline' 0 C--N 1.382 2.338 0 C-N-CA 122.446 2.098 . . . . 75.420000000000002 111.837 179.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.425 ' HB3' HD23 ' A' ' 17' ' ' LEU . 20.4 t70 -165.45 118.29 1.17 Allowed 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.317 0.647 . . . . 74.239999999999995 110.258 173.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.3 mp -60.23 -34.33 73.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.917 0.887 . . . . 72.230000000000004 110.735 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.96 -19.62 65.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.484 -0.78 . . . . 70.310000000000002 112.329 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.639 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -81.86 -21.85 37.26 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 121.929 -0.482 . . . . 62.530000000000001 109.825 174.85 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 22.8 mmt -76.31 -37.83 56.9 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-O 121.06 0.457 . . . . 62.009999999999998 110.224 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.6 HG11 ' HG3' ' A' ' 45' ' ' ARG . 11.0 p -71.78 -30.49 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.962 0 CA-C-N 115.424 -0.807 . . . . 62.130000000000003 111.964 -177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.639 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 18.3 ptpt -71.23 -33.84 70.23 Favored 'General case' 0 C--N 1.351 0.667 0 O-C-N 122.184 -0.322 . . . . 72.209999999999994 110.773 -175.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -59.76 -45.59 91.78 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.265 0.626 . . . . 70.540000000000006 111.028 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.42 -31.66 60.45 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 116.134 -0.484 . . . . 72.140000000000001 110.448 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.15 -34.58 90.34 Favored Glycine 0 C--N 1.356 1.639 0 N-CA-C 112.404 -0.278 . . . . 71.150000000000006 112.404 175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 -72.31 -46.81 54.08 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 123.495 0.718 . . . . 51.32 110.105 174.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.4 pt-20 -62.06 -31.49 71.92 Favored 'General case' 0 N--CA 1.48 1.029 0 O-C-N 123.413 0.446 . . . . 74.450000000000003 110.539 -174.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 95.3 m -53.33 -43.73 67.9 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.729 0.812 . . . . 74.420000000000002 112.602 179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.7 t80 -57.88 -44.25 86.58 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-O 121.373 0.606 . . . . 74.329999999999998 110.23 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -68.53 -16.92 64.03 Favored 'General case' 0 CA--C 1.557 1.217 0 C-N-CA 124.653 1.181 . . . . 61.240000000000002 111.797 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 29.4 mmmt -84.29 -0.97 54.46 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.623 -0.673 . . . . 63.149999999999999 110.096 175.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 103.7 5.03 45.51 Favored Glycine 0 C--N 1.356 1.683 0 C-N-CA 123.219 0.438 . . . . 65.530000000000001 112.708 176.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.455 ' HB3' ' N ' ' A' ' 35' ' ' ALA . 70.6 m-20 -77.74 128.53 34.19 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 122.771 0.428 . . . . 74.329999999999998 110.256 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.467 ' HB2' ' HD3' ' A' ' 33' ' ' PRO . 22.4 m-85 -111.06 -54.65 0.05 OUTLIER Pre-proline 0 CA--C 1.557 1.249 0 C-N-CA 123.405 0.682 . . . . 74.329999999999998 109.357 167.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.503 ' O ' ' HB3' ' A' ' 36' ' ' MET . 2.8 Cg_exo -77.4 -42.23 0.3 Allowed 'Trans proline' 0 C--N 1.394 2.928 0 C-N-CA 121.65 1.566 . . . . 75.030000000000001 111.257 171.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.454 HE21 ' HA ' ' A' ' 34' ' ' GLN . 0.1 OUTLIER -68.46 -24.39 64.7 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 122.974 0.509 . . . . 72.319999999999993 111.188 -176.874 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.455 ' N ' ' HB3' ' A' ' 31' ' ' ASP . . . -64.09 -32.67 74.32 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 123.072 0.549 . . . . 71.340000000000003 110.165 171.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.512 ' HA ' ' NH2' ' A' ' 56' ' ' ARG . 7.4 tmm? -64.31 -43.29 95.14 Favored 'General case' 0 C--N 1.354 0.781 0 C-N-CA 123.048 0.539 . . . . 61.140000000000001 110.499 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -70.27 -38.28 75.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.524 0.73 . . . . 74.209999999999994 111.269 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -71.04 -21.02 62.31 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 115.442 -0.799 . . . . 70.299999999999997 112.443 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -85.65 -29.9 23.65 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 119.179 -0.439 . . . . 70.150000000000006 111.251 167.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 86.5 m -60.09 -42.11 93.93 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 118.41 0.55 . . . . 72.439999999999998 110.852 -175.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -58.81 -35.35 72.71 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.75 0.82 . . . . 74.319999999999993 111.606 174.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.17 -32.16 62.99 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.554 0.741 . . . . 74.310000000000002 111.208 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.91 -31.96 54.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.453 0.701 . . . . 71.420000000000002 110.056 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' THR . 33.8 mmtp -68.72 -29.22 67.6 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.031 0.532 . . . . 74.25 110.811 175.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.6 ' HG3' HG11 ' A' ' 19' ' ' VAL . 14.3 mmp_? -80.67 -50.21 10.23 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.483 1.113 . . . . 73.129999999999995 111.617 178.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.411 HD21 ' HG ' ' A' ' 52' ' ' LEU . 0.3 OUTLIER -133.74 81.14 53.92 Favored Pre-proline 0 N--CA 1.48 1.037 0 C-N-CA 123.951 0.9 . . . . 74.049999999999997 111.081 -176.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -79.08 0.64 9.85 Favored 'Trans proline' 0 C--N 1.377 2.059 0 C-N-CA 122.814 2.342 . . . . 53.43 112.013 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -90.12 -23.68 21.3 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.029 1.332 . . . . 51.439999999999998 110.113 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -76.87 109.06 10.35 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.142 0.577 . . . . 74.510000000000005 110.341 -171.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.408 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -77.2 -27.57 53.58 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.267 0.84 . . . . 65.010000000000005 113.267 -172.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -22.55 54.27 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 118.062 0.392 . . . . 71.430000000000007 110.143 -179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.417 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 1.4 mm? -61.85 -40.24 94.62 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.369 0.667 . . . . 73.030000000000001 109.301 168.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -73.0 -37.49 66.96 Favored 'General case' 0 CA--C 1.547 0.862 0 O-C-N 124.091 0.869 . . . . 61.329999999999998 111.792 175.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 89.7 p -62.88 -25.07 68.12 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 119.583 1.083 . . . . 72.129999999999995 110.442 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -82.55 -28.55 30.92 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.214 1.006 . . . . 75.109999999999999 111.195 173.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.512 ' NH2' ' HA ' ' A' ' 36' ' ' MET . 3.2 mmp_? -65.97 -56.79 9.88 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.807 0.443 . . . . 71.409999999999997 110.376 175.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -54.24 -38.39 65.69 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.997 0.919 . . . . 50.229999999999997 111.88 174.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.74 -28.74 67.89 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.662 0.785 . . . . 71.25 112.498 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.5 t -81.39 -45.15 16.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.46 0.704 . . . . 62.229999999999997 111.231 178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -60.66 -30.48 69.92 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.765 0.826 . . . . 75.239999999999995 112.288 -173.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 36.9 p -60.94 -38.5 86.07 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.229 0.611 . . . . 71.140000000000001 111.396 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -70.52 -29.92 66.54 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 109.859 179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.2 mt -84.14 -1.12 54.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.444 0.697 . . . . 55.009999999999998 110.8 176.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.429 HD13 ' HE1' ' A' ' 66' ' ' PHE . 3.9 mm? 65.51 13.3 8.79 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 124.795 1.238 . . . . 63.119999999999997 111.575 -177.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -87.67 52.66 2.54 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.938 1.695 . . . . 63.210000000000001 110.547 177.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.527 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 55.5 m-85 -57.6 -28.31 63.52 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.476 0.71 . . . . 75.430000000000007 111.705 -179.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -59.49 -39.08 82.62 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.195 0.598 . . . . 61.509999999999998 110.983 174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.7 mt -74.47 -38.83 62.83 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 115.486 -0.779 . . . . 73.329999999999998 108.964 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.78 -30.64 71.61 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.606 0.763 . . . . 70.209999999999994 111.619 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 93.1 mt -69.14 -65.03 0.76 Allowed 'General case' 0 C--N 1.355 0.818 0 C-N-CA 123.213 0.605 . . . . 74.329999999999998 109.833 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.83 -32.55 65.86 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.321 0.649 . . . . 54.409999999999997 112.092 -174.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -63.72 -46.43 85.44 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.146 0.979 . . . . 71.140000000000001 111.482 178.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.415 ' SG ' ' HD2' ' A' ' 90' ' ' LYS . 28.9 p -74.47 -25.7 59.56 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 116.796 -0.184 . . . . 72.019999999999996 110.765 177.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 15.6 mm-40 -69.94 -27.98 65.2 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 112.219 0.451 . . . . 72.310000000000002 112.219 176.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -88.91 -34.89 16.78 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 122.303 0.241 . . . . 73.109999999999999 110.544 172.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.408 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 51.7 t -61.33 -33.75 74.12 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.552 0.741 . . . . 75.109999999999999 111.931 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.69 -25.54 33.04 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.396 0.678 . . . . 72.510000000000005 110.69 178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -72.15 -37.81 69.31 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.429 0.633 . . . . 71.319999999999993 109.501 -179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 61.3 mt -79.64 -36.37 37.93 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.048 -0.978 . . . . 73.019999999999996 110.708 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -146.86 94.48 4.65 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 124.035 0.934 . . . . 75.319999999999993 108.637 -170.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.44 -15.64 34.57 Favored 'Trans proline' 0 C--N 1.367 1.546 0 C-N-CA 122.431 2.087 . . . . 75.430000000000007 112.785 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 18.9 p -108.39 20.51 18.51 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.169 0.988 . . . . 53.509999999999998 112.426 -176.407 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -63.5 118.22 7.84 Favored 'General case' 0 N--CA 1.486 1.365 0 CA-C-O 121.225 0.536 . . . . 73.540000000000006 110.056 175.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.449 HD13 ' HB2' ' A' ' 114' ' ' ASP . 48.7 mt -88.29 -48.6 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.524 0.729 . . . . 75.230000000000004 111.687 -168.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -68.57 -35.26 77.15 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 116.295 -0.411 . . . . 60.130000000000003 110.795 -173.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.66 66.52 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-N 115.733 -0.667 . . . . 71.219999999999999 112.945 176.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -70.42 -34.45 72.52 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.271 0.628 . . . . 71.230000000000004 111.843 174.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.404 ' HB ' HH11 ' A' ' 89' ' ' ARG . 32.9 m -63.19 -41.2 99.14 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 120.769 0.318 . . . . 64.219999999999999 110.336 176.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.404 HH11 ' HB ' ' A' ' 88' ' ' THR . 8.0 mpt_? -80.2 -25.63 39.58 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 111.155 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.415 ' HD2' ' SG ' ' A' ' 73' ' ' CYS . 0.1 OUTLIER -65.1 -51.12 63.22 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.124 0.97 . . . . 74.439999999999998 109.386 172.525 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -66.49 -34.84 78.82 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.867 0.867 . . . . 72.140000000000001 111.069 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.55 -36.44 78.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.753 0.821 . . . . 73.219999999999999 111.322 177.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.88 -49.85 48.2 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.972 -0.558 . . . . 74.340000000000003 110.188 177.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 98.2 mt -57.84 -39.16 77.01 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.809 0.844 . . . . 73.310000000000002 111.05 178.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -56.39 -40.17 74.18 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.296 1.038 . . . . 75.310000000000002 110.108 174.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.37 -21.51 59.63 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 116.157 -0.474 . . . . 64.540000000000006 110.25 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 24.3 mmt -93.59 4.48 53.88 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.48 0.712 . . . . 73.450000000000003 109.77 179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 72.44 9.64 5.78 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.749 1.62 . . . . 72.329999999999998 112.603 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -90.96 55.9 3.05 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.381 1.072 . . . . 51.43 110.964 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -57.44 -35.09 69.65 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.241 1.016 . . . . 73.430000000000007 110.481 174.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 40.8 p -56.66 -34.23 67.14 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 113.687 -1.597 . . . . 74.299999999999997 112.006 175.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -90.05 -39.68 12.77 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.177 0.591 . . . . 74.040000000000006 110.231 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.61 84.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.193 0.997 . . . . 61.039999999999999 111.765 -177.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 21.3 ptp -65.24 -23.67 67.13 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.662 0.785 . . . . 64.200000000000003 111.975 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 7.9 m-20 -75.94 -38.16 57.9 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 109.697 -0.482 . . . . 63.240000000000002 109.697 171.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 60.6 t -73.98 -40.91 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 122.843 0.457 . . . . 53.329999999999998 110.802 -169.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.14 -39.6 90.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.255 0.622 . . . . 74.299999999999997 109.505 175.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -66.37 -45.76 78.99 Favored 'General case' 0 C--N 1.353 0.719 0 CA-C-N 114.703 -1.135 . . . . 53.240000000000002 108.22 -176.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 105' ' ' ASP . 31.7 mmmt -72.04 -23.8 61.44 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 115.086 -0.961 . . . . 63.520000000000003 111.131 -179.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -48.43 65.76 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.855 0.462 . . . . 63.340000000000003 109.785 170.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.667 HD23 ' SG ' ' A' ' 117' ' ' CYS . 93.2 mt -66.13 -28.31 68.7 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.282 0.633 . . . . 62.219999999999999 111.01 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.435 ' HB3' ' HA ' ' A' ' 109' ' ' LYS . 26.1 t70 -69.89 -23.83 63.31 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.986 1.314 . . . . 71.040000000000006 110.551 -179.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 89.0 mt -86.48 -61.23 1.79 Allowed 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.878 0.871 . . . . 72.239999999999995 109.526 172.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.449 ' HB2' HD13 ' A' ' 84' ' ' ILE . 3.8 m-20 -148.27 120.3 8.25 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.872 0.869 . . . . 64.230000000000004 110.104 176.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.7 p -54.37 -26.36 29.7 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 124.102 0.961 . . . . 65.010000000000005 111.641 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 26.3 t -50.56 -21.24 1.44 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.825 1.25 . . . . 72.340000000000003 112.709 177.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.667 ' SG ' HD23 ' A' ' 111' ' ' LEU . 16.2 p -76.41 18.08 0.33 Allowed 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 113.308 0.855 . . . . 75.430000000000007 113.308 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -39.83 -22.54 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.561 0 N-CA-C 115.754 1.761 . . . . 75.439999999999998 115.754 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -50.21 -43.08 52.51 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.466 0.707 . . . . 72.129999999999995 111.929 169.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -67.6 -28.76 68.03 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.226 1.011 . . . . 72.120000000000005 111.943 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -72.63 -37.96 67.86 Favored 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 109.566 -0.531 . . . . 61.530000000000001 109.566 -179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -59.55 -42.82 93.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.062 0.945 . . . . 60.399999999999999 109.705 171.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.1 88.08 Favored Glycine 0 C--N 1.355 1.614 0 CA-C-N 114.869 -1.059 . . . . 74.129999999999995 112.809 175.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 40.4 t80 -61.93 -47.99 82.41 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 119.146 -0.455 . . . . 74.150000000000006 112.165 175.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -52.74 -24.66 9.17 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 123.498 0.499 . . . . 73.230000000000004 112.317 178.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.5 ttt180 -81.12 -44.52 17.8 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 119.408 -0.33 . . . . 63.32 110.743 168.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 72.4 m -63.43 -44.11 95.51 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 122.969 0.507 . . . . 34.140000000000001 112.027 -171.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 17.1 ptm -62.06 -46.04 90.89 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.112 0.565 . . . . 75.140000000000001 111.36 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.2 ptm -76.46 -28.04 56.39 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 122.495 -0.128 . . . . 73.510000000000005 110.848 -176.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.92 -43.39 92.95 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.159 0.984 . . . . 32.310000000000002 111.852 -173.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -69.47 -23.12 63.6 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.955 0.502 . . . . 71.230000000000004 111.224 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -101.68 35.13 2.4 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.226 0.611 . . . . 72.430000000000007 109.891 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.057 0 C-N-CA 124.492 1.117 . . . . 74.420000000000002 108.681 174.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.4 mtp . . . . . 0 N--CA 1.481 1.077 0 N-CA-C 110.116 -0.328 . . . . 74.019999999999996 110.116 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -149.78 24.71 1.17 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-N 116.221 -0.445 . . . . 73.239999999999995 112.526 -177.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.8 m170 -81.87 59.27 4.21 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 121.646 0.736 . . . . 63.119999999999997 110.436 176.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -140.03 143.4 36.39 Favored 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.647 1.179 . . . . 74.150000000000006 108.125 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -87.39 159.02 18.87 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.967 -0.753 . . . . 73.140000000000001 108.967 169.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.2 m-70 -71.14 -157.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.565 0.746 . . . . 73.400000000000006 109.437 174.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.6 p80 -53.99 155.45 3.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.647 0.379 . . . . 74.200000000000003 111.061 170.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -54.67 156.89 3.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.486 0.714 . . . . 54.100000000000001 110.803 172.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.2 t -56.47 159.94 3.43 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.37 0.668 . . . . 73.099999999999994 111.51 -178.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.6 m80 -52.12 152.43 3.23 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.539 0.736 . . . . 74.230000000000004 110.861 176.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.2 mtt -63.31 -14.08 45.83 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.096 0.958 . . . . 50.140000000000001 113.573 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -58.23 140.9 83.0 Favored Pre-proline 0 N--CA 1.486 1.336 0 CA-C-O 117.965 -1.017 . . . . 54.32 109.446 164.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.494 ' HB2' HD21 ' A' ' 17' ' ' LEU . 9.3 Cg_endo -47.03 -51.76 8.83 Favored 'Trans proline' 0 C--N 1.391 2.791 0 C-N-CA 123.506 2.804 . . . . 74.430000000000007 113.194 -168.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 5.4 t70 -177.86 128.9 0.14 Allowed 'General case' 0 N--CA 1.484 1.254 0 O-C-N 123.8 0.687 . . . . 63.439999999999998 109.984 164.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.409 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.9 mp -60.32 -30.36 69.45 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.417 0.687 . . . . 65.450000000000003 111.88 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.3 -20.7 65.65 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 112.149 0.426 . . . . 62.32 112.149 178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.655 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.7 pp -87.09 -15.79 37.47 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 118.367 0.531 . . . . 75.420000000000002 110.046 174.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 25.6 mmt -81.18 -28.48 34.94 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.043 0.537 . . . . 71.150000000000006 111.411 -178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -67.25 -33.03 60.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 122.693 0.397 . . . . 71.200000000000003 111.122 177.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 15.8 ptpt -80.02 -22.84 41.95 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 119.551 -0.261 . . . . 63.520000000000003 110.927 178.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -70.9 -48.54 53.12 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.176 0.591 . . . . 54.229999999999997 110.306 176.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.78 -22.87 59.69 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 116.039 -0.528 . . . . 72.340000000000003 109.624 176.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.45 -48.73 84.74 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.144 -0.935 . . . . 74.120000000000005 111.982 168.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -60.54 -40.07 90.19 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 124.07 0.948 . . . . 73.450000000000003 111.429 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -71.2 -36.61 71.98 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 123.223 0.327 . . . . 75.319999999999993 110.562 -175.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 73.8 m -68.81 -42.85 76.72 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-O 120.913 0.387 . . . . 72.510000000000005 110.861 176.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -59.82 -34.3 72.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.93 0.892 . . . . 72.310000000000002 109.915 175.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -70.89 -20.32 62.51 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.656 1.182 . . . . 74.230000000000004 111.187 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.19 -8.86 59.63 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 109.622 -0.51 . . . . 72.329999999999998 109.622 174.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.53 3.2 53.27 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.007 -0.542 . . . . 63.399999999999999 113.232 177.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 34' ' ' GLN . 17.7 m-20 -76.38 90.35 3.22 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 117.277 0.539 . . . . 74.209999999999994 110.375 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.496 ' HB3' HD21 ' A' ' 63' ' ' LEU . 22.4 m-85 -78.02 -44.28 2.28 Favored Pre-proline 0 CA--C 1.561 1.396 0 CA-C-O 118.019 -0.991 . . . . 72.030000000000001 113.04 177.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.43 -54.87 2.16 Favored 'Trans proline' 0 C--N 1.393 2.869 0 CA-C-N 121.186 1.459 . . . . 54.130000000000003 111.061 172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.549 ' HB3' ' HB3' ' A' ' 31' ' ' ASP . 9.7 tp-100 -62.31 -28.42 69.72 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.83 0.852 . . . . 74.310000000000002 111.06 -177.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.604 ' HA ' ' CE1' ' A' ' 38' ' ' HIS . . . -59.76 -48.23 82.51 Favored 'General case' 0 C--N 1.354 0.802 0 C-N-CA 122.951 0.501 . . . . 53.439999999999998 111.205 170.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 15.4 tmm? -69.86 -26.96 64.45 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 124.056 0.848 . . . . 72.409999999999997 109.671 -173.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -69.87 -59.21 3.07 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.442 0.697 . . . . 54.109999999999999 111.012 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.604 ' CE1' ' HA ' ' A' ' 35' ' ' ALA . 2.0 p-80 -70.79 -19.48 62.69 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 113.335 0.865 . . . . 71.420000000000002 113.335 -171.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -72.78 -26.97 61.72 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.818 -0.552 . . . . 72.340000000000003 110.228 172.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 91.0 m -65.35 -40.39 93.54 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.618 0.767 . . . . 71.200000000000003 111.374 173.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -22.96 52.06 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.575 0.226 . . . . 62.130000000000003 110.568 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.64 -27.4 60.43 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.034 -0.53 . . . . 74.310000000000002 110.368 173.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.4 mp -63.36 -35.7 73.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.518 0.727 . . . . 53.520000000000003 109.778 168.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -69.33 -17.04 63.67 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.96 0.504 . . . . 45.229999999999997 111.272 177.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' HA ' ' HE ' ' A' ' 45' ' ' ARG . 1.9 mmp_? -97.43 -35.82 10.55 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.005 0.922 . . . . 73.439999999999998 111.253 178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -143.52 84.89 9.73 Favored Pre-proline 0 N--CA 1.484 1.259 0 C-N-CA 123.457 0.703 . . . . 71.319999999999993 111.078 177.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -75.61 -16.31 18.96 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 122.552 2.168 . . . . 52.219999999999999 112.715 178.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -78.51 -17.88 55.59 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.76 0.824 . . . . 71.109999999999999 111.867 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -83.31 93.04 7.64 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.143 0.577 . . . . 71.430000000000007 109.722 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB2' ' HB2' ' A' ' 79' ' ' LEU . . . -68.48 -24.69 64.72 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.951 0.901 . . . . 63.210000000000001 112.725 -175.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.422 ' HB2' ' HE2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -67.63 -28.83 68.06 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 109.761 -0.459 . . . . 70.400000000000006 109.761 179.857 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -72.47 -29.03 63.29 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.099 0.96 . . . . 72.239999999999995 111.032 -179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -65.08 -52.51 55.15 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 108.292 -1.003 . . . . 74.5 108.292 169.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.1 t -62.14 -20.78 64.46 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.71 0.804 . . . . 55.140000000000001 113.018 -177.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 10.2 m-20 -58.68 -34.17 70.96 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.894 0.878 . . . . 74.409999999999997 111.092 171.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -65.0 -44.56 88.82 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.416 -0.811 . . . . 65.030000000000001 109.754 177.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.85 -36.65 83.94 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.541 0.736 . . . . 64.109999999999999 111.532 176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.97 -27.28 69.02 Favored 'General case' 0 CA--C 1.546 0.81 0 O-C-N 124.069 0.856 . . . . 72.140000000000001 111.161 178.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 60.6 m -81.44 -48.94 11.24 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 122.863 0.465 . . . . 60.420000000000002 110.049 169.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -54.8 -34.56 62.86 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.131 1.372 . . . . 73.120000000000005 112.812 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.6 p -58.17 -49.93 75.3 Favored 'General case' 0 CA--C 1.551 0.995 0 O-C-N 123.307 0.38 . . . . 75.219999999999999 110.795 177.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -16.39 56.6 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 122.292 0.237 . . . . 74.310000000000002 111.044 -178.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.496 HD21 ' HB3' ' A' ' 32' ' ' TYR . 66.3 mt -86.02 -2.85 58.7 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.201 0.6 . . . . 74.219999999999999 111.062 172.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 64.69 15.26 9.63 Favored 'General case' 0 C--N 1.371 1.528 0 C-N-CA 123.92 0.888 . . . . 74.400000000000006 111.768 -178.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -91.05 44.55 1.2 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.167 1.387 . . . . 64.420000000000002 110.499 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.434 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 72.1 m-85 -57.03 -28.75 62.78 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.946 0.898 . . . . 75.340000000000003 112.367 -177.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -60.1 -40.77 90.77 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.05 0.452 . . . . 65.129999999999995 110.663 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -75.48 -34.68 60.9 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.224 -0.898 . . . . 75.549999999999997 109.199 -179.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.71 -32.94 74.59 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.925 0.89 . . . . 72.319999999999993 111.543 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 90.4 mt -62.7 -62.99 1.36 Allowed 'General case' 0 C--N 1.356 0.861 0 O-C-N 123.517 0.51 . . . . 71.140000000000001 110.58 174.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 -31.47 72.6 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 123.893 0.745 . . . . 62.140000000000001 112.614 -174.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.65 -45.39 79.13 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 124.092 0.87 . . . . 64.310000000000002 110.912 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 90' ' ' LYS . 40.7 t -71.38 -27.63 63.47 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 116.187 -0.46 . . . . 74.519999999999996 110.979 178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.532 ' O ' HG22 ' A' ' 77' ' ' ILE . 48.1 mt-10 -69.18 -43.16 74.78 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.296 0.638 . . . . 75.439999999999998 111.174 175.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -75.51 -28.43 59.13 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 117.617 0.189 . . . . 61.109999999999999 111.174 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 43.9 t -60.76 -27.55 68.06 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.663 0.785 . . . . 53.409999999999997 111.717 177.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 74' ' ' GLU . 0.1 OUTLIER -70.09 -30.11 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 122.824 0.45 . . . . 73.329999999999998 109.996 177.51 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -72.48 -28.84 63.15 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 122.989 0.516 . . . . 72.030000000000001 110.559 -174.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' ' 50' ' ' ALA . 85.2 mt -93.31 -35.09 13.24 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.371 0.668 . . . . 73.430000000000007 111.141 179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -142.94 102.83 5.26 Favored Pre-proline 0 N--CA 1.482 1.174 0 C-N-CA 122.546 0.338 . . . . 75.420000000000002 110.22 177.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.77 -17.33 23.02 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.776 2.317 . . . . 45.340000000000003 114.257 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 79.7 p -108.16 17.07 22.7 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 118.146 0.43 . . . . 73.519999999999996 112.112 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -71.92 93.23 1.33 Allowed 'General case' 0 C--N 1.355 0.811 0 N-CA-C 109.545 -0.539 . . . . 72.5 109.545 176.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 33.5 mt -61.76 -36.49 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.935 1.294 . . . . 71.540000000000006 111.57 -171.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 11.1 mmpt? -70.43 -25.07 63.04 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.95 -0.568 . . . . 74.319999999999993 110.895 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -66.44 -38.12 93.26 Favored Glycine 0 C--N 1.346 1.115 0 N-CA-C 110.985 -0.846 . . . . 61.130000000000003 110.985 172.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.511 ' HD2' HG13 ' A' ' 106' ' ' VAL . 82.6 m-85 -73.04 -30.88 64.06 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.412 0.685 . . . . 65.140000000000001 111.474 176.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 9.5 m -71.05 -31.59 68.07 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.143 0.577 . . . . 54.350000000000001 110.063 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.534 ' HA ' ' HE ' ' A' ' 89' ' ' ARG . 9.7 mmp_? -84.42 -36.27 22.49 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.547 0.739 . . . . 72.450000000000003 112.177 176.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 55.3 tptt -64.37 -52.77 56.65 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.459 0.704 . . . . 64.319999999999993 110.467 -174.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -67.62 -33.14 74.38 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 124.173 0.921 . . . . 73.510000000000005 111.686 -176.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.23 -38.27 90.46 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.225 0.61 . . . . 61.340000000000003 111.023 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -71.88 -42.95 66.19 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.464 -0.789 . . . . 53.219999999999999 110.447 177.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 97.9 mt -60.99 -36.91 80.72 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.701 0.8 . . . . 55.329999999999998 110.749 179.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -57.37 -39.4 75.93 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.533 0.733 . . . . 74.400000000000006 110.571 171.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -80.09 -2.17 43.24 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.021 0.528 . . . . 72.409999999999997 110.921 -179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.9 mmt -116.2 15.27 15.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.918 0.887 . . . . 74.150000000000006 111.252 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm 67.23 7.29 5.38 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 124.709 1.203 . . . . 73.239999999999995 113.199 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.8 47.57 1.48 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.491 0.717 . . . . 71.329999999999998 110.836 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -50.69 -38.91 49.61 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 124.537 1.135 . . . . 75.109999999999999 112.403 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.7 p -57.01 -46.64 82.16 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 123.846 0.716 . . . . 75.140000000000001 110.807 175.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -77.89 -30.13 50.6 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.326 0.651 . . . . 74.319999999999993 110.52 -175.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.57 -51.29 60.87 Favored 'General case' 0 C--N 1.342 0.266 0 CA-C-N 115.518 -0.765 . . . . 43.25 109.531 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.711 ' SD ' ' HB3' ' A' ' 128' ' ' MET . 75.8 mtm -57.04 -32.41 66.17 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 124.125 0.89 . . . . 52.509999999999998 112.334 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 71.7 m-20 -63.49 -44.08 95.39 Favored 'General case' 0 N--CA 1.479 1.003 0 O-C-N 123.607 0.567 . . . . 65.019999999999996 110.166 173.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.511 HG13 ' HD2' ' A' ' 87' ' ' TYR . 73.4 t -80.19 -28.77 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 123.887 0.875 . . . . 74.120000000000005 111.319 -170.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.623 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 62.1 m-85 -65.01 -45.92 83.53 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 109.09 -0.707 . . . . 63.219999999999999 109.09 170.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.02 -41.01 91.26 Favored 'General case' 0 N--CA 1.48 1.03 0 O-C-N 124.307 1.004 . . . . 74.420000000000002 109.661 178.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.436 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -62.11 -41.89 98.67 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.013 0.525 . . . . 63.25 111.186 175.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.6 -37.36 83.63 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 123.393 0.433 . . . . 71.310000000000002 111.195 175.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' TYR . 67.4 mt -72.6 -30.37 64.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.761 0.824 . . . . 73.049999999999997 111.328 176.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -75.79 -36.99 59.59 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.695 0.798 . . . . 62.409999999999997 109.715 -176.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 97.2 mt -65.68 -45.29 83.43 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 115.046 -0.979 . . . . 71.099999999999994 109.998 174.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -158.8 121.8 3.73 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.288 0.635 . . . . 63.420000000000002 110.575 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 66.4 p -53.15 -43.66 67.18 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.309 1.044 . . . . 65.219999999999999 111.781 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 41.3 t -63.28 -5.02 2.93 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.878 0.871 . . . . 50.200000000000003 112.705 -176.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 36.7 t -77.81 16.76 0.64 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.541 0.736 . . . . 73.099999999999994 111.684 166.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -39.63 -18.02 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.462 0 N-CA-C 116.295 1.961 . . . . 74.140000000000001 116.295 174.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -57.74 -33.54 68.56 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 119.269 0.941 . . . . 72.129999999999995 110.739 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -70.86 -28.21 64.4 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.501 1.12 . . . . 72.200000000000003 111.426 173.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 124' ' ' TYR . . . -71.03 -33.22 70.11 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 120.918 0.39 . . . . 75.310000000000002 110.312 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -68.43 -39.55 81.51 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.995 -0.548 . . . . 62.109999999999999 109.786 175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -69.97 -28.23 72.06 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.557 -0.747 . . . . 61.310000000000002 112.988 174.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 121' ' ' ALA . 5.2 t80 -59.57 -55.0 39.99 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.453 1.101 . . . . 64.239999999999995 110.234 175.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.21 -33.82 54.43 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.122 0.889 . . . . 61.32 111.711 175.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 19.2 tpt180 -73.48 -30.32 63.08 Favored 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 123.0 0.52 . . . . 74.109999999999999 111.651 -179.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.623 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 86.6 m -82.94 -45.04 14.64 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 118.107 0.412 . . . . 74.549999999999997 111.181 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.711 ' HB3' ' SD ' ' A' ' 104' ' ' MET . 21.5 ptm -60.54 -43.97 96.62 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 123.06 0.225 . . . . 50.539999999999999 110.879 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 20.7 ptm -65.27 -32.59 74.33 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.242 0.217 . . . . 55.450000000000003 110.931 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.22 94.71 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.602 0.761 . . . . 74.150000000000006 111.851 -173.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -76.6 -26.65 55.24 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 116.243 -0.435 . . . . 65.230000000000004 111.201 173.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 11.4 m-30 -97.83 37.54 1.39 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.071 0.462 . . . . 52.520000000000003 110.408 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.254 1.339 0 C-N-CA 124.139 0.976 . . . . 43.030000000000001 108.482 174.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 120.465 0.174 . . . . 72.109999999999999 111.138 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.18 29.06 67.08 Favored Glycine 0 C--N 1.35 1.354 0 CA-C-O 119.51 -0.606 . . . . 72.140000000000001 114.07 174.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.0 t60 54.64 73.06 0.42 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.191 0.996 . . . . 74.219999999999999 109.98 -177.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 46.8 t60 -73.79 -40.1 63.65 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 115.182 -0.917 . . . . 53.039999999999999 110.25 -177.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 -84.3 96.35 8.99 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.911 -0.586 . . . . 75.319999999999993 109.995 175.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -86.25 154.49 21.24 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.844 0.858 . . . . 74.299999999999997 108.824 169.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.54 98.05 0.08 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.581 0.352 . . . . 62.240000000000002 111.151 176.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.9 t60 51.54 57.78 6.2 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.603 1.561 . . . . 73.420000000000002 111.779 170.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.8 t -72.32 89.43 1.22 Allowed 'General case' 0 C--O 1.242 0.67 0 CA-C-N 115.313 -0.858 . . . . 75.129999999999995 109.594 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -90.34 40.17 1.0 Allowed 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 122.54 1.162 . . . . 73.239999999999995 109.955 -178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.4 mtm -93.4 -35.71 12.87 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 107.941 -1.133 . . . . 72.120000000000005 107.941 168.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 49.8 82.11 0.25 Allowed Pre-proline 0 C--N 1.36 1.035 0 C-N-CA 124.844 1.258 . . . . 63.229999999999997 110.614 -170.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.49 -23.58 70.87 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 122.617 2.211 . . . . 74.0 111.785 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 17' ' ' LEU . 24.7 t70 -170.06 104.68 0.31 Allowed 'General case' 0 C--N 1.352 0.678 0 C-N-CA 123.675 0.79 . . . . 71.530000000000001 108.913 -177.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.417 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.7 mp -61.36 -24.36 66.42 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.938 0.495 . . . . 63.420000000000002 111.571 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.44 -29.95 70.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.242 0.617 . . . . 42.009999999999998 111.811 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.618 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 1.1 pp -73.63 -17.08 61.2 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.214 -0.304 . . . . 75.200000000000003 110.338 179.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 21.7 mmt -81.64 -40.01 23.54 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 122.75 0.42 . . . . 73.030000000000001 110.065 -176.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.565 HG11 ' HG3' ' A' ' 45' ' ' ARG . 14.6 p -72.59 -24.89 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.177 0 C-N-CA 123.28 0.632 . . . . 50.420000000000002 112.447 -175.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 17.8 ptpt -71.06 -32.86 69.67 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 122.177 -0.327 . . . . 60.030000000000001 110.331 176.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.9 m-20 -66.35 -45.85 78.76 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.219 1.008 . . . . 72.400000000000006 111.222 -175.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -71.91 -32.89 67.83 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.64 -0.709 . . . . 75.329999999999998 110.886 176.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -55.53 -58.34 14.38 Favored Glycine 0 CA--C 1.536 1.379 0 O-C-N 123.93 0.769 . . . . 72.209999999999994 113.886 175.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -64.7 -29.24 70.23 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.233 0.613 . . . . 74.010000000000005 112.136 178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 0.1 OUTLIER -70.53 -37.9 74.15 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 119.299 -0.382 . . . . 64.519999999999996 109.981 177.634 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 77.1 m -62.12 -45.04 95.22 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.312 0.645 . . . . 74.200000000000003 110.32 178.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -52.02 -48.38 64.55 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.357 1.063 . . . . 73.409999999999997 109.845 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -62.17 -28.43 69.65 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 114.14 -1.391 . . . . 73.530000000000001 111.784 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 28.7 mmmt -73.27 -16.18 61.4 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.178 0.444 . . . . 72.540000000000006 110.401 -178.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.87 -1.99 27.29 Favored Glycine 0 C--N 1.35 1.344 0 N-CA-C 112.024 -0.43 . . . . 55.340000000000003 112.024 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 9.9 m-20 -85.18 68.12 10.41 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.476 0.71 . . . . 72.430000000000007 109.238 175.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -66.59 -53.91 26.42 Favored Pre-proline 0 CA--C 1.562 1.419 0 CA-C-O 118.213 -0.899 . . . . 73.319999999999993 111.365 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -62.74 -48.07 7.75 Favored 'Trans proline' 0 C--N 1.395 3.0 0 C-N-CA 121.588 1.525 . . . . 73.420000000000002 111.553 178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.599 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 25.0 mm-40 -58.7 -32.73 69.43 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.683 0.793 . . . . 71.430000000000007 111.602 179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.73 72.82 Favored 'General case' 0 C--N 1.356 0.858 0 O-C-N 123.757 0.661 . . . . 70.430000000000007 111.274 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.405 ' SD ' ' CE1' ' A' ' 60' ' ' TYR . 60.8 mtm -60.95 -43.68 98.37 Favored 'General case' 0 N--CA 1.48 1.068 0 O-C-N 123.563 0.54 . . . . 73.109999999999999 109.556 -179.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -73.64 -28.83 61.99 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 114.356 -1.293 . . . . 74.430000000000007 110.686 -177.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 48.7 m-70 -69.1 -32.42 71.84 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 115.884 -0.598 . . . . 71.150000000000006 110.788 170.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.412 ' O ' HG13 ' A' ' 43' ' ' ILE . 23.7 m-85 -78.07 -29.55 49.25 Favored 'General case' 0 C--O 1.213 -0.839 0 CA-C-O 118.695 -0.669 . . . . 73.420000000000002 110.52 176.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.462 ' O ' ' HG2' ' A' ' 44' ' ' LYS . 18.4 m -60.34 -43.35 96.53 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.08 0.552 . . . . 74.349999999999994 109.922 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.459 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 7.8 tp10 -59.09 -47.47 85.14 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.618 1.167 . . . . 71.209999999999994 109.989 173.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.16 -23.96 64.92 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 115.812 -0.631 . . . . 54.219999999999999 112.097 -179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 39' ' ' TYR . 82.1 mt -72.51 -34.38 48.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 123.594 0.758 . . . . 72.349999999999994 109.495 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 40' ' ' THR . 31.6 mmtp -66.39 -26.84 67.44 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.187 0.595 . . . . 74.209999999999994 110.212 174.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.565 ' HG3' HG11 ' A' ' 19' ' ' VAL . 27.6 mmt180 -90.93 -38.9 12.58 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.008 0.923 . . . . 60.450000000000003 111.304 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.85 75.74 9.88 Favored Pre-proline 0 CA--C 1.558 1.27 0 N-CA-C 112.934 0.716 . . . . 62.219999999999999 112.934 -172.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -72.29 -11.88 27.13 Favored 'Trans proline' 0 C--N 1.371 1.75 0 C-N-CA 122.612 2.208 . . . . 24.32 113.401 -179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -75.62 -25.73 57.16 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.339 0.655 . . . . 73.129999999999995 110.283 179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.491 ' HB3' HD23 ' A' ' 52' ' ' LEU . 4.1 m-20 -79.22 102.19 8.4 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.238 1.015 . . . . 73.329999999999998 112.414 -171.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.588 ' HB1' ' SG ' ' A' ' 76' ' ' CYS . . . -58.82 -34.36 71.44 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.739 1.615 . . . . 61.43 113.342 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HD2' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -62.78 -27.07 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.354 0.502 . . . . 74.329999999999998 112.354 -177.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.491 HD23 ' HB3' ' A' ' 49' ' ' ASP . 4.6 mm? -66.48 -43.12 86.31 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 109.975 -0.38 . . . . 63.399999999999999 109.975 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -76.39 -29.75 57.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.759 0.824 . . . . 73.439999999999998 111.344 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 41.2 t -75.32 -27.9 59.44 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.328 0.651 . . . . 62.109999999999999 110.307 178.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.26 -29.99 42.87 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.384 0.674 . . . . 63.25 110.545 173.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 -61.67 -49.19 77.49 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.219 -0.66 . . . . 63.119999999999997 109.219 170.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.96 -43.4 98.92 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.07 0.948 . . . . 61.240000000000002 111.365 177.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.58 63.59 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 61.140000000000001 111.413 179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 53.9 t -81.06 -47.99 12.8 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.116 0.566 . . . . 71.409999999999997 110.362 171.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.405 ' CE1' ' SD ' ' A' ' 36' ' ' MET . 25.8 m-85 -60.86 -31.54 70.99 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.232 0.613 . . . . 61.100000000000001 112.09 -176.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.4 p -58.25 -45.86 87.02 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-O 121.589 0.709 . . . . 72.430000000000007 110.045 170.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 mmmp? -74.13 -21.7 59.77 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.23 -0.895 . . . . 70.310000000000002 111.021 -174.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 70.0 mt -97.94 11.18 38.31 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.963 0.905 . . . . 71.209999999999994 110.775 177.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 67.81 5.88 4.75 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 124.411 1.084 . . . . 54.329999999999998 112.88 177.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -91.26 50.38 1.75 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.677 1.191 . . . . 74.099999999999994 110.358 176.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.404 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 58.8 m-85 -57.38 -25.5 59.58 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.84 0.856 . . . . 70.450000000000003 111.655 -179.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.48 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 26.7 mm-40 -60.33 -43.81 96.08 Favored 'General case' 0 C--N 1.353 0.732 0 C-N-CA 123.415 0.686 . . . . 44.200000000000003 110.044 174.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.8 mt -77.19 -26.71 53.12 Favored 'General case' 0 N--CA 1.474 0.774 0 O-C-N 123.672 0.608 . . . . 62.25 110.623 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.4 -35.39 80.75 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.23 0.612 . . . . 44.100000000000001 110.668 172.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 85.8 mt -63.06 -46.73 86.12 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.782 -0.451 . . . . 74.420000000000002 109.782 170.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' GLN . 1.9 mmmp? -59.64 -48.1 82.98 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 124.224 0.952 . . . . 73.450000000000003 111.57 -174.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -64.46 -40.42 95.69 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.556 0.743 . . . . 60.030000000000001 112.276 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.477 ' HB2' ' HD3' ' A' ' 90' ' ' LYS . 71.4 m -74.45 -35.83 63.35 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 111.919 0.34 . . . . 54.439999999999998 111.919 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.23 -21.73 58.4 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.663 0.385 . . . . 70.140000000000001 111.632 -175.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -88.34 -34.63 17.56 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 120.761 0.315 . . . . 74.319999999999993 110.235 171.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.588 ' SG ' ' HB1' ' A' ' 50' ' ' ALA . 44.5 t -62.57 -25.42 68.06 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.187 0.995 . . . . 74.120000000000005 112.011 -178.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -27.24 39.66 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.22 0 C-N-CA 123.745 0.818 . . . . 75.129999999999995 110.401 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -74.75 -31.41 61.79 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 122.844 0.458 . . . . 55.329999999999998 110.622 178.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 64.1 mt -81.46 -40.77 22.79 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.312 0.645 . . . . 72.299999999999997 110.346 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -151.1 96.74 3.25 Favored Pre-proline 0 CA--C 1.552 1.037 0 CA-C-N 115.66 -0.7 . . . . 73.120000000000005 109.252 -178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.06 -12.85 17.49 Favored 'Trans proline' 0 C--N 1.38 2.211 0 C-N-CA 123.222 2.615 . . . . 71.209999999999994 113.735 -178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 37.6 p -106.4 18.82 21.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.639 0.376 . . . . 63.32 111.5 177.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -74.84 102.63 4.78 Favored 'General case' 0 C--N 1.354 0.798 0 CA-C-O 120.792 0.329 . . . . 64.0 110.258 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.641 HG23 ' SG ' ' A' ' 117' ' ' CYS . 55.7 mt -56.54 -51.57 63.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 125.0 1.32 . . . . 74.409999999999997 112.566 -175.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.421 ' O ' ' HG2' ' A' ' 89' ' ' ARG . 31.2 mmmt -65.71 -31.36 72.32 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.474 0.484 . . . . 63.420000000000002 111.641 -172.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -67.24 -38.98 92.16 Favored Glycine 0 C--N 1.343 0.952 0 N-CA-C 111.474 -0.65 . . . . 42.140000000000001 111.474 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -68.47 -40.05 81.16 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.073 0.949 . . . . 74.519999999999996 112.017 177.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' ' 120' ' ' ALA . 74.5 p -74.5 -31.8 62.3 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 122.282 0.233 . . . . 74.409999999999997 111.23 -176.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 85' ' ' LYS . 6.0 mmp_? -79.3 -34.42 42.4 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 122.947 0.499 . . . . 73.150000000000006 110.935 176.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 73' ' ' CYS . 22.4 tptm -67.1 -49.84 63.62 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.095 0.558 . . . . 72.200000000000003 110.429 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.525 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -65.06 -30.5 71.47 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.395 0.678 . . . . 55.32 111.344 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.32 -42.55 99.01 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.013 0.525 . . . . 63.420000000000002 110.553 172.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -65.85 -44.54 85.15 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 115.894 -0.594 . . . . 71.219999999999999 110.572 176.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 95.2 mt -56.73 -43.38 80.6 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.079 0.952 . . . . 53.299999999999997 110.885 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -54.42 -37.16 64.78 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.692 0.797 . . . . 62.219999999999999 111.092 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.51 -20.57 58.63 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.729 0.411 . . . . 61.409999999999997 110.71 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 22.3 mmt -90.35 7.91 36.16 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.4 0.68 . . . . 75.510000000000005 110.667 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 69.73 9.35 7.14 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.135 1.374 . . . . 55.299999999999997 111.94 -173.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 102' ' ' LYS . 48.0 m-20 -85.92 47.27 1.42 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.899 0.88 . . . . 74.219999999999999 110.803 -178.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -51.18 -39.9 57.46 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.178 0.991 . . . . 71.540000000000006 111.904 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 56.9 p -65.76 -33.18 75.27 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.447 1.099 . . . . 74.230000000000004 111.927 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.469 ' HB2' ' HB3' ' A' ' 99' ' ' ASP . 11.0 mmpt? -87.37 -31.3 20.19 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.094 0.558 . . . . 74.450000000000003 110.238 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.52 -49.6 62.63 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.12 0.968 . . . . 64.299999999999997 109.675 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . 0.511 ' HB3' ' HE2' ' A' ' 104' ' ' MET . 17.8 ptp -57.39 -29.89 64.46 Favored 'General case' 0 N--CA 1.478 0.95 0 O-C-N 124.063 0.852 . . . . 51.539999999999999 111.786 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 74.0 m-20 -64.04 -45.42 88.94 Favored 'General case' 0 C--N 1.353 0.75 0 O-C-N 124.063 0.852 . . . . 75.299999999999997 109.798 174.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.525 ' HB ' ' HB2' ' A' ' 91' ' ' ALA . 49.1 t -78.15 -26.25 14.34 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 O-C-N 124.063 0.852 . . . . 65.439999999999998 110.455 -172.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.636 ' HE2' ' HG ' ' A' ' 127' ' ' CYS . 53.3 m-85 -68.34 -46.93 68.82 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.414 0.686 . . . . 74.310000000000002 109.775 170.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -45.44 90.97 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.157 0.983 . . . . 65.439999999999998 109.261 178.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.1 mmmt -61.48 -44.56 96.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.811 0.845 . . . . 70.540000000000006 110.921 177.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.561 ' HB1' ' SG ' ' A' ' 117' ' ' CYS . . . -59.38 -39.64 84.0 Favored 'General case' 0 N--CA 1.48 1.05 0 O-C-N 123.927 0.767 . . . . 72.099999999999994 111.587 177.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 84.3 mt -65.78 -40.56 92.09 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.751 0.82 . . . . 64.120000000000005 110.805 173.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -66.45 -24.5 66.45 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.002 0.921 . . . . 72.230000000000004 111.37 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 63.3 mt -67.01 -50.46 62.07 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.101 -0.703 . . . . 75.549999999999997 109.101 175.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.417 ' HB3' HD11 ' A' ' 84' ' ' ILE . 32.1 t70 -165.92 139.35 4.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.579 0.752 . . . . 74.129999999999995 109.964 178.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 52.5 m -63.79 -30.01 71.15 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.166 0.587 . . . . 61.240000000000002 112.45 -174.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 31.5 t -68.79 4.8 1.3 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 123.056 0.542 . . . . 51.219999999999999 111.715 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.641 ' SG ' HG23 ' A' ' 84' ' ' ILE . 51.0 t -86.99 17.6 4.05 Favored 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 124.883 1.273 . . . . 52.32 111.939 165.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -39.26 -23.48 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.773 0 N-CA-C 116.123 1.897 . . . . 62.039999999999999 116.123 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -54.39 -35.26 62.66 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.696 0.798 . . . . 74.109999999999999 111.667 174.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.514 ' HB2' HG22 ' A' ' 88' ' ' THR . . . -75.46 -24.17 56.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.528 1.131 . . . . 63.130000000000003 111.574 177.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -67.98 -41.68 81.97 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.306 -0.628 . . . . 43.219999999999999 109.306 177.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -58.77 -48.78 80.04 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.492 -0.776 . . . . 75.239999999999995 109.854 172.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -60.77 -31.5 75.86 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 115.386 -0.825 . . . . 54.43 113.533 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.4 ' CD1' ' HB2' ' A' ' 104' ' ' MET . 7.6 t80 -66.09 -60.18 3.06 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.611 0.764 . . . . 75.340000000000003 110.427 176.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -53.47 -32.16 48.82 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 122.904 0.481 . . . . 51.539999999999999 111.938 176.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -67.87 -40.02 83.65 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 124.671 1.189 . . . . 75.120000000000005 111.597 176.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.636 ' HG ' ' HE2' ' A' ' 107' ' ' TYR . 63.8 m -82.42 -36.46 26.64 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 118.083 0.401 . . . . 74.219999999999999 111.994 -175.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -67.55 -38.93 84.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 122.134 0.173 . . . . 74.299999999999997 111.044 178.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 18.5 ptm -70.35 -30.26 67.15 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 117.812 0.278 . . . . 33.25 110.824 175.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -65.11 -31.45 72.65 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.865 0.866 . . . . 72.310000000000002 112.035 -174.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -86.11 -29.37 23.38 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 122.671 0.388 . . . . 63.549999999999997 110.838 172.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 17.5 m-30 -95.96 45.36 1.08 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.086 0.554 . . . . 72.409999999999997 110.878 -177.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.248 1.008 0 C-N-CA 123.692 0.797 . . . . 72.409999999999997 110.24 176.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptt? . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 109.599 -0.519 . . . . 73.0 109.599 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.65 -94.36 0.42 Allowed Glycine 0 C--N 1.342 0.912 0 O-C-N 123.489 0.493 . . . . 75.140000000000001 114.233 176.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.4 p-80 -84.72 129.99 34.75 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 121.34 0.591 . . . . 73.439999999999998 112.397 -168.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.5 m80 -149.45 132.19 15.96 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.227 1.811 . . . . 73.239999999999995 106.328 167.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.7 p80 -68.72 149.62 48.85 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 117.733 0.242 . . . . 61.140000000000001 110.509 -178.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -68.83 167.35 15.74 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.396 0.678 . . . . 75.439999999999998 111.353 179.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -59.89 156.18 14.93 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.412 0.685 . . . . 71.349999999999994 111.282 178.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -67.42 153.27 44.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.906 0.483 . . . . 72.439999999999998 111.231 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.7 t -60.72 134.38 57.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.988 1.315 . . . . 74.450000000000003 112.901 -165.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.429 ' HB2' ' HG3' ' A' ' 13' ' ' PRO . 53.3 m80 -142.11 152.83 43.63 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.605 1.162 . . . . 72.430000000000007 109.16 172.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.2 mtm -58.96 -58.88 6.7 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.488 1.115 . . . . 51.350000000000001 109.945 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -132.94 96.28 18.1 Favored Pre-proline 0 N--CA 1.468 0.464 0 N-CA-C 107.5 -1.296 . . . . 75.200000000000003 107.5 168.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HG3' ' HB2' ' A' ' 10' ' ' HIS . 20.9 Cg_exo -64.03 -37.37 43.41 Favored 'Trans proline' 0 C--N 1.372 1.799 0 C-N-CA 122.286 1.991 . . . . 74.439999999999998 110.811 175.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -172.63 113.39 0.27 Allowed 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 114.951 -1.022 . . . . 75.299999999999997 109.457 -175.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.498 HD12 ' H ' ' A' ' 15' ' ' LEU . 5.1 mp -60.99 -33.09 72.7 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.329 0.652 . . . . 70.109999999999999 110.356 178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 46' ' ' ASN . . . -60.77 -27.26 67.84 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.839 -1.073 . . . . 62.310000000000002 111.807 176.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HA ' ' HE3' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -75.44 -28.28 59.27 Favored 'General case' 0 C--N 1.355 0.813 0 N-CA-C 109.456 -0.572 . . . . 74.510000000000005 109.456 177.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 23.2 mmt -73.84 -45.88 48.51 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 109.712 -0.477 . . . . 54.399999999999999 109.712 -177.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.7 p -70.7 -30.84 43.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.479 0.712 . . . . 74.319999999999993 111.99 -176.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.588 ' HE3' ' HA ' ' A' ' 17' ' ' LEU . 19.0 ptpt -72.44 -33.32 66.99 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 122.603 0.361 . . . . 72.530000000000001 111.794 -173.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -64.04 -46.19 85.5 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.961 0.904 . . . . 53.32 111.308 -169.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.445 ' HD2' ' H ' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -75.15 -26.03 58.82 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 115.921 -0.582 . . . . 70.430000000000007 110.802 175.561 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -60.07 -51.44 58.86 Favored Glycine 0 C--N 1.354 1.545 0 O-C-N 123.569 0.543 . . . . 61.219999999999999 113.059 -179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.522 ' HA ' ' OH ' ' A' ' 39' ' ' TYR . 9.9 p30 -70.8 -33.5 70.79 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.102 0.408 . . . . 64.230000000000004 112.102 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 29' ' ' LYS . 4.3 pt-20 -73.04 -29.29 62.87 Favored 'General case' 0 C--N 1.355 0.835 0 CA-C-O 118.807 -0.616 . . . . 74.209999999999994 110.528 -176.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 91.8 m -52.34 -44.3 65.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.504 0.722 . . . . 65.319999999999993 112.402 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.49 ' HZ ' ' HG3' ' A' ' 62' ' ' LYS . 84.5 t80 -55.14 -45.11 75.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 124.531 1.132 . . . . 71.310000000000002 110.187 174.045 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -71.23 -16.83 62.52 Favored 'General case' 0 CA--C 1.553 1.063 0 CA-C-N 114.875 -1.057 . . . . 75.230000000000004 111.654 178.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 26.5 mmmt -85.08 -0.6 55.03 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.497 -0.557 . . . . 63.130000000000003 109.497 175.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.9 -6.48 62.3 Favored Glycine 0 C--N 1.358 1.806 0 N-CA-C 111.959 -0.457 . . . . 62.030000000000001 111.959 -178.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.645 ' HB3' ' HB2' ' A' ' 34' ' ' GLN . 19.0 m-20 -90.83 77.02 6.28 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.404 0.682 . . . . 75.519999999999996 110.121 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 4.4 m-30 -60.64 -51.55 78.97 Favored Pre-proline 0 CA--C 1.564 1.484 0 C-N-CA 123.725 0.81 . . . . 75.450000000000003 111.724 178.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.76 -41.18 3.17 Favored 'Trans proline' 0 C--N 1.394 2.94 0 C-N-CA 121.434 1.422 . . . . 52.229999999999997 112.795 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.645 ' HB2' ' HB3' ' A' ' 31' ' ' ASP . 20.3 mm-40 -61.03 -36.0 78.4 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.497 0.719 . . . . 71.129999999999995 110.958 -179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -42.21 89.7 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.918 0.761 . . . . 73.340000000000003 110.562 172.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.48 ' HG3' ' HG3' ' A' ' 56' ' ' ARG . 55.0 ttp -73.33 -36.6 66.22 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.997 0.919 . . . . 74.510000000000005 110.359 -173.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -71.8 -32.91 68.1 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 123.836 0.855 . . . . 64.450000000000003 110.118 176.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -76.4 -24.91 54.09 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.578 -0.737 . . . . 71.540000000000006 110.266 176.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.522 ' OH ' ' HA ' ' A' ' 24' ' ' ASN . 18.0 m-85 -67.53 -39.35 85.05 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-O 119.08 -0.486 . . . . 74.510000000000005 109.996 171.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 19.5 m -57.53 -46.59 83.67 Favored 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 117.925 0.33 . . . . 44.310000000000002 111.261 -179.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.58 -27.09 61.98 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.97 0.508 . . . . 75.430000000000007 111.471 177.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.88 -42.94 80.47 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.166 0.586 . . . . 44.420000000000002 110.336 175.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.8 -30.23 46.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 C-N-CA 124.613 1.165 . . . . 52.409999999999997 111.085 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -62.94 -36.2 82.64 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 121.282 0.563 . . . . 75.329999999999998 110.065 177.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -82.32 -41.79 19.61 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 114.695 -1.139 . . . . 73.010000000000005 110.336 178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.488 ' HB3' ' HB1' ' A' ' 16' ' ' ALA . 1.0 OUTLIER -126.14 81.88 66.11 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 124.106 0.962 . . . . 74.340000000000003 110.968 -175.098 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.406 ' O ' HD13 ' A' ' 79' ' ' LEU . 96.4 Cg_endo -75.89 -15.69 18.71 Favored 'Trans proline' 0 C--N 1.376 1.996 0 C-N-CA 122.432 2.088 . . . . 63.530000000000001 112.611 176.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -95.18 -20.52 19.18 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.264 0.625 . . . . 74.239999999999995 112.527 -177.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.443 ' HB3' HD23 ' A' ' 52' ' ' LEU . 1.7 m-20 -75.43 80.98 2.48 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.905 0.482 . . . . 75.420000000000002 110.504 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . . . -63.71 -19.18 64.72 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.571 1.148 . . . . 51.329999999999998 112.401 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.3 -29.31 63.73 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 122.794 0.437 . . . . 62.219999999999999 110.955 175.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.579 HD11 ' HB2' ' A' ' 20' ' ' LYS . 3.4 mm? -65.37 -42.33 92.85 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 123.284 0.634 . . . . 74.109999999999999 110.172 173.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.466 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 86.2 m-85 -60.53 -46.17 91.17 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.451 -1.25 . . . . 75.219999999999999 109.718 172.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.5 t -64.08 -29.38 70.52 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.323 1.049 . . . . 74.329999999999998 111.941 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -68.64 -40.43 80.29 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.974 0.51 . . . . 74.109999999999999 110.037 175.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.48 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 41.2 ttt180 -66.3 -39.25 89.22 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 115.388 -0.823 . . . . 70.340000000000003 110.279 177.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.82 -34.7 78.98 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.973 0.909 . . . . 52.539999999999999 110.689 174.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -72.6 -22.5 60.96 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 124.022 0.929 . . . . 73.340000000000003 111.518 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 62.9 m -76.85 -41.2 44.98 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 109.486 -0.561 . . . . 73.230000000000004 109.486 171.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -60.13 -20.94 60.77 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 113.731 1.011 . . . . 75.120000000000005 113.731 178.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 50.5 p -65.53 -42.29 92.13 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 109.36 -0.608 . . . . 70.239999999999995 109.36 172.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HG3' ' HZ ' ' A' ' 27' ' ' PHE . 31.8 mmmt -76.1 -20.51 57.61 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.045 0.938 . . . . 75.099999999999994 110.992 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.1 mt -93.77 -0.5 55.87 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.176 0.99 . . . . 74.129999999999995 110.638 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.1 12.46 7.02 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.027 1.331 . . . . 55.340000000000003 112.828 177.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -93.67 56.75 2.42 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 124.323 1.049 . . . . 75.420000000000002 109.819 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.492 ' O ' ' HG ' ' A' ' 70' ' ' LEU . 81.5 m-85 -57.59 -26.63 61.77 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.273 -0.876 . . . . 75.010000000000005 111.003 177.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -51.42 -43.15 61.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.199 1.0 . . . . 61.25 111.457 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.2 mt -76.95 -36.28 56.64 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.241 -0.89 . . . . 62.420000000000002 110.084 -178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -62.95 -35.23 79.46 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.517 0.727 . . . . 71.430000000000007 111.961 177.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 66' ' ' PHE . 57.2 mt -67.3 -60.22 2.77 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.664 0.786 . . . . 72.439999999999998 110.656 177.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -65.33 -31.68 72.94 Favored 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.741 -0.663 . . . . 64.420000000000002 111.674 -174.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.434 ' O ' ' SG ' ' A' ' 76' ' ' CYS . 22.0 t70 -62.36 -46.43 88.69 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 123.792 0.683 . . . . 62.130000000000003 109.291 173.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 53.2 t -62.04 -34.26 75.91 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 122.511 0.324 . . . . 71.219999999999999 111.215 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 70' ' ' LEU . 8.6 mm-40 -70.71 -29.95 66.37 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 113.469 0.914 . . . . 63.420000000000002 113.469 -179.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -86.92 -39.39 15.8 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 121.161 0.505 . . . . 62.109999999999999 110.507 175.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' A' ' 53' ' ' TYR . 59.6 m -70.4 -24.06 62.87 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.921 0.889 . . . . 73.540000000000006 112.159 -177.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.461 HD13 ' HA ' ' A' ' 81' ' ' PRO . 0.2 OUTLIER -65.8 -28.25 43.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 109.319 -0.623 . . . . 74.349999999999994 109.319 173.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mm-40 -74.8 -28.78 60.86 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 122.484 0.313 . . . . 71.319999999999993 110.374 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 47' ' ' PRO . 90.1 mt -82.29 -56.8 3.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.963 0.905 . . . . 64.099999999999994 110.133 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 50' ' ' ALA . 13.7 tp10 -126.94 102.95 24.14 Favored Pre-proline 0 CA--C 1.54 0.574 0 CA-C-N 114.875 -1.057 . . . . 72.340000000000003 108.811 177.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.461 ' HA ' HD13 ' A' ' 77' ' ' ILE . 18.7 Cg_exo -66.24 -47.44 3.33 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 122.668 2.245 . . . . 72.129999999999995 112.87 -178.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.0 p -88.0 18.06 4.5 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.115 0.783 . . . . 73.430000000000007 113.115 -166.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -64.36 91.24 0.08 Allowed 'General case' 0 CA--C 1.559 1.304 0 CA-C-O 121.764 0.792 . . . . 64.140000000000001 110.781 176.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.539 HD13 ' HB2' ' A' ' 117' ' ' CYS . 50.5 mt -54.02 -27.45 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.396 0.679 . . . . 74.219999999999999 111.692 175.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.4 mptp? -75.78 -31.11 59.34 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-N 115.255 -0.884 . . . . 73.25 109.85 -175.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -74.51 -38.94 43.23 Favored Glycine 0 C--N 1.347 1.149 0 N-CA-C 111.213 -0.755 . . . . 72.230000000000004 111.213 171.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -64.44 -44.07 92.3 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.757 0.823 . . . . 73.439999999999998 113.03 -179.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 31.8 m -62.78 -40.2 96.57 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.932 0.493 . . . . 54.240000000000002 110.181 -178.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -72.24 -37.41 69.14 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.327 -0.852 . . . . 73.349999999999994 111.147 178.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -63.46 -48.94 75.6 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.471 0.709 . . . . 73.519999999999996 110.566 -179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.43 ' HB2' ' HB ' ' A' ' 106' ' ' VAL . . . -71.28 -31.59 67.66 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.716 0.806 . . . . 62.409999999999997 111.606 -177.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -65.52 -33.85 76.89 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.072 0.549 . . . . 53.130000000000003 110.675 173.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.82 -45.9 63.74 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.659 -0.7 . . . . 71.540000000000006 110.048 174.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.93 -35.97 71.83 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.932 0.893 . . . . 75.0 111.162 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -55.53 -41.44 73.17 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.658 0.783 . . . . 74.109999999999999 110.84 173.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -77.32 -15.01 59.62 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.705 -0.679 . . . . 74.129999999999995 110.335 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 23.2 mmt -98.27 0.35 45.49 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.631 0.772 . . . . 70.420000000000002 110.107 177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 72.16 17.19 5.08 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 125.429 1.492 . . . . 63.310000000000002 112.545 177.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -94.5 54.18 1.78 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.71 0.804 . . . . 72.099999999999994 110.473 177.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.4 ' HD2' ' HB3' ' A' ' 131' ' ' GLN . 18.0 m-85 -54.13 -32.06 54.1 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.657 0.783 . . . . 73.349999999999994 112.339 177.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 72.5 p -61.83 -40.88 96.82 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.313 1.045 . . . . 73.299999999999997 111.17 175.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' O ' HG23 ' A' ' 106' ' ' VAL . 11.1 mmpt? -85.65 -29.88 23.67 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.245 0.618 . . . . 55.009999999999998 110.364 -177.53 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -53.82 44.5 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.394 0.678 . . . . 62.450000000000003 109.587 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' MET . . . . . . . . . . . . . 17.9 ptp -61.99 -27.55 68.94 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-N 115.598 -0.728 . . . . 74.319999999999993 112.055 -179.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 109' ' ' LYS . 20.2 t70 -63.58 -43.29 97.43 Favored 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.069 0.856 . . . . 63.219999999999999 109.69 173.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 102' ' ' LYS . 70.8 t -73.27 -37.56 52.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 CA-C-N 115.109 -0.95 . . . . 74.200000000000003 109.728 -175.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . 0.616 ' HE2' ' SG ' ' A' ' 127' ' ' CYS . 23.8 m-85 -63.69 -42.15 98.05 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.443 0.697 . . . . 71.299999999999997 111.034 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.48 -50.51 72.44 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.735 0.814 . . . . 72.109999999999999 109.376 -179.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 113' ' ' LEU . 32.5 mmmt -67.35 -36.14 80.79 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.34 -0.845 . . . . 74.310000000000002 111.322 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.54 -42.72 86.77 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.771 0.428 . . . . 34.119999999999997 110.674 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.658 HD21 ' HB2' ' A' ' 121' ' ' ALA . 80.7 mt -61.04 -37.33 82.22 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 123.478 0.711 . . . . 72.019999999999996 111.197 174.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -60.89 -39.7 90.26 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.069 -0.969 . . . . 64.019999999999996 110.806 177.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 109' ' ' LYS . 81.0 mt -65.09 -63.25 1.15 Allowed 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 123.118 0.567 . . . . 72.239999999999995 111.046 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -146.27 151.2 37.16 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.045 0.538 . . . . 65.129999999999995 111.011 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.501 ' O ' ' HG2' ' A' ' 118' ' ' LYS . 27.1 m -64.08 -18.72 64.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.047 0.939 . . . . 43.229999999999997 110.939 172.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.2 t -57.39 -14.22 4.46 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.596 1.158 . . . . 45.399999999999999 111.771 173.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.736 ' SG ' ' HB3' ' A' ' 120' ' ' ALA . 49.5 t -77.33 10.43 2.51 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 124.458 1.103 . . . . 73.109999999999999 113.43 173.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 115' ' ' SER . 30.8 mmmt -50.5 -37.92 41.41 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 119.413 1.006 . . . . 75.129999999999995 113.074 175.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -53.64 -37.41 63.08 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.396 0.678 . . . . 71.239999999999995 111.38 174.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.736 ' HB3' ' SG ' ' A' ' 117' ' ' CYS . . . -89.33 -16.13 31.78 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 124.597 1.159 . . . . 63.219999999999999 110.978 -178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.658 ' HB2' HD21 ' A' ' 111' ' ' LEU . . . -70.15 -45.14 67.4 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 108.177 -1.045 . . . . 71.5 108.177 176.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -62.1 -43.89 97.84 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.378 -1.283 . . . . 72.239999999999995 109.69 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -59.59 -32.17 72.84 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 115.28 -0.873 . . . . 64.239999999999995 113.424 177.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 25.3 t80 -58.89 -55.38 35.88 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 123.007 0.523 . . . . 63.240000000000002 110.871 174.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -47.54 -38.36 14.0 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 123.963 0.905 . . . . 74.230000000000004 111.713 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -70.24 -38.82 75.27 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 124.185 0.994 . . . . 74.010000000000005 112.074 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.616 ' SG ' ' HE2' ' A' ' 107' ' ' TYR . 96.0 m -80.71 -41.42 23.66 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 111.658 -175.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 21.0 ptm -66.17 -45.48 80.75 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 122.398 0.279 . . . . 75.430000000000007 110.341 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 14.3 ptt? -64.72 -28.93 69.93 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 119.459 -0.305 . . . . 71.349999999999994 110.82 -179.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -59.39 -40.46 86.65 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.535 0.734 . . . . 25.23 112.174 -174.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 100' ' ' TYR . 19.6 pt20 -86.93 -25.07 24.55 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 116.306 -0.406 . . . . 54.32 111.563 175.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -102.16 39.45 1.48 Allowed 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 109.657 -0.497 . . . . 71.25 109.657 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.111 -0.7 . . . . 61.240000000000002 109.111 -173.765 . . . . . . . . 0 0 . 1 stop_ save_